0 B18R3.36580 c1ccc2cc(ccc2c1)CN3CCSC3 4a5710739799cf50f97c2c8ca667d1f1 [0,0,0,0,0,0|4,0,0]=4 1 B18R3.36580 c1ccc2cc(ccc2c1)NC3CCCC3 b25654865157c486a3562bf37591c9d7 [0,0,0,0,0,0|3,0,1]=4 2 B18R3.36580 c1ccc2cc(ccc2c1)Nc3c[nH]cn3 a35de1c45efa914081f87a5555c872aa [0,0,0,0,0,0|3,0,1]=4 3 B18R3.36580 c1ccc2cc(ccc2c1)Nc3c[nH]nn3 2a0bbeff0e3f37d895390441dbc5c097 [0,0,0,0,0,0|4,0,0]=4 4 B18R3.36580 c1ccc2cc(ccc2c1)Nc3cc[nH]n3 74a41be6e1181fee472f3c421a244dc6 [0,0,0,0,0,0|3,0,1]=4 5 B18R3.36580 c1ccc2cc(ccc2c1)Nc3ccon3 13f2914f1e63936ba2b9839e10ecd8a8 [0,0,0,0,0,0|3,0,1]=4 6 B18R3.36580 c1ccc2cc(ccc2c1)Nc3ccsn3 67b22ee24736012e58ec7841fce6d4dc [0,0,0,0,0,0|3,0,1]=4 7 B18R3.36580 c1ccc2cc(ccc2c1)Nc3cnon3 965f5fce40a44e370d154ce018e46cca [0,0,0,0,0,0|4,0,0]=4 8 B18R3.36580 c1ccc2cc(ccc2c1)Nc3cocn3 8acfa15f07a0e521c15cc59b499bb0b6 [0,0,0,0,0,0|3,0,1]=4 9 B18R3.36580 c1ccc2cc(ccc2c1)Nc3cscn3 fc7ceb0cabe5f303e9d65eba5ea937be [0,0,0,0,0,0|3,0,1]=4 10 B18R3.36580 c1ccc2cc(ccc2c1)Nc3csnn3 1dd58a178986165a73f5f4f0dc3fbfed [0,0,0,0,0,0|4,0,0]=4 11 B18R3.36580 c1ccc2cc(ccc2c1)Nc3nc[nH]n3 14ef0f9ce304d350e650ef686e77de7f [0,0,0,0,0,0|2,0,2]=4 12 B18R3.36580 c1ccc2cc(ccc2c1)Nc3ncc[nH]3 4774852755e2a63bbd8bf3b354b5e18c [0,0,0,0,0,0|1,0,2]=3 13 B18R3.36580 c1ccc2cc(ccc2c1)Nc3ncco3 7beb4e49e6fc3e0802fd615161c0a453 [0,0,0,0,0,0|2,0,2]=4 14 B18R3.36580 c1ccc2cc(ccc2c1)Nc3nccs3 e3da373bb9e3effb2079f3c2189f0994 [0,0,0,0,0,0|2,0,2]=4 15 B18R3.36580 c1ccc2cc(ccc2c1)Nc3ncon3 6566b0a842d72e1c8605cfa3b2fc5db8 [0,0,0,0,0,0|2,0,2]=4 16 B18R3.36580 c1ccc2cc(ccc2c1)Nc3nn[nH]n3 4a2863d8e238b8309fdaaa0dfca2375d [0,0,0,0,0,0|3,0,1]=4 17 B18R3.36580 c1ccc2cc(ccc2c1)Nc3nnco3 e1ecdaf291bf59346cee4af6934b619d [0,0,0,0,0,0|3,0,1]=4 18 B18R3.36580 c1ccc2cc(ccc2c1)Nc3nncs3 78e54b1895dee1366aef8f6e053ef21f [0,0,0,0,0,0|3,0,1]=4 19 B18R3.36580 c1ccc2cc(ccc2c1)OC3CCCC3 0caaaa8867053e8187eddd543bf8a572 [0,0,0,0,0,0|3,0,1]=4 20 B18R3.36580 c1ccc2cc(ncc2c1)Nc3ncc[nH]3 f8039f6af9105d8d0aaf30e204477452 [0,0,0,0,0,0|2,0,2]=4 21 B18R3.36580 c1ccc2nc(ccc2c1)Nc3ncc[nH]3 1d48e22aa2053d791054543df3a3fcdd [0,0,0,0,0,0|2,0,2]=4 22 B18R3.36580 c1ccc2ncc(cc2c1)Nc3ncc[nH]3 26e3c9bc879adcba3c290fec91659edf [0,0,0,0,0,0|2,0,2]=4 23 B18R3.36580 c1cnc2ccc(cc2c1)Nc3ncc[nH]3 c853b3cad5732c79cd82ae0341a972ce [0,0,0,0,0,0|2,0,2]=4 24 B19R3.292 Fc1cc2ccccc2cc1Nc3ncc[nH]3 f6157c56d99948cf8f96d9617fa3ede3 [0,1,0,0,0,0|1,0,2]=4 25 B19R3.8809 CC1CCCN1Cc2ccc3ccccc3c2 433dce003573403d443b714f063a1445 [0,1,0,0,0,0|3,0,0]=4 26 B19R3.8809 C[C@@H]1CCCN1Cc2ccc3ccccc3c2 1c30c3c69f8d1df57ca3dc492c056f6c [0,1,0,0,0,0|3,0,0]=4 27 B19R3.8809 C[C@H]1CCCN1Cc2ccc3ccccc3c2 7efd273fe782c75420770662fc68a338 [0,1,0,0,0,0|3,0,0]=4 28 B19R3.8809 Cn1ccnc1Nc2ccc3ccccc3c2 ac13e51f0ca7dcf51deda2514ddd19f8 [0,1,0,0,0,0|1,0,2]=4 29 B19R3.8809 Cn1cnnc1Nc2ccc3ccccc3c2 84dd7b01c406af224eb9fcd102295b3b [0,1,0,0,0,0|2,0,1]=4 30 B19R3.8809 OC1CCCN1Cc2ccc3ccccc3c2 817a9dcd37dfc28a2c554f42cf11afdd [0,1,0,0,0,0|3,0,0]=4 31 B19R3.50998 CC1CCN(C1)Cc2ccc3ccccc3c2 bad4e67564eb098670ae1411d3a1edca [0,1,0,0,0,0|3,0,0]=4 32 B19R3.50998 Cc1cnc([nH]1)Nc2ccc3ccccc3c2 c71704900c4425a5443462e3d1999cb0 [0,1,0,0,0,0|1,0,2]=4 33 B19R3.50998 Cc1n[nH]c(n1)Nc2ccc3ccccc3c2 3ddb3082e59056b9dba68e698a5ff47c [0,1,0,0,0,0|2,0,1]=4 34 B19R3.50998 FC1CCN(C1)Cc2ccc3ccccc3c2 cf567b8e2c5d43ac3d6e4a4de399212a [0,1,0,0,0,0|3,0,0]=4 35 B19R3.50998 F[C@@H]1CCN(C1)Cc2ccc3ccccc3c2 49cb687f6f7aad9bc942dfd7cc9ff27b [0,1,0,0,0,0|3,0,0]=4 36 B19R3.50998 F[C@H]1CCN(C1)Cc2ccc3ccccc3c2 1e91d76ff0fbb90fde2ffed628499c53 [0,1,0,0,0,0|3,0,0]=4 37 B19R3.50998 O=c1[nH]nc([nH]1)Nc2ccc3ccccc3c2 84c00b039da6ab9aa2a065f425068658 [0,1,0,0,0,0|2,0,1]=4 38 B19R3.50998 OC1CCN(C1)Cc2ccc3ccccc3c2 b6827cb4fef76a4e36d3d0d236a71fe1 [0,1,0,0,0,0|3,0,0]=4 39 B19R3.50998 O[C@@H]1CCN(C1)Cc2ccc3ccccc3c2 370f6d0bd5d09f1c98f15a532876cd5c [0,1,0,0,0,0|3,0,0]=4 40 B19R3.50998 O[C@H]1CCN(C1)Cc2ccc3ccccc3c2 3e34560260670897205f83e30f9433f1 [0,1,0,0,0,0|3,0,0]=4 41 B19R3.54903 Cc1ccc2ccc(cc2c1)Nc3ncc[nH]3 5d88c37892de49ec5bbdb484422884a0 [0,1,0,0,0,0|1,0,2]=4 42 B19R3.54903 Oc1ccc2ccc(cc2c1)Nc3ncc[nH]3 f89aa59634481f375ba3c10bfa25f735 [0,1,0,0,0,0|1,0,2]=4 43 B19R3.55014 Oc1ccc2cc(ccc2c1)Nc3ncc[nH]3 0becd701b227cd311ffd5c37f97143a3 [0,1,0,0,0,0|1,0,2]=4 44 B19R3.152263 Oc1cccc2c1ccc(c2)Nc3ncc[nH]3 65fdd79457b62445ae9109ddb232a6e1 [0,1,0,0,0,0|1,0,2]=4 45 B19R3.2183900 Fc1c(ccc2c1cccc2)Nc3ncc[nH]3 c6d59ae08ea9cf3d5444fd4bcd85a6c2 [0,1,0,0,0,0|1,0,2]=4 46 B17R2.2159 CCCN(C)Cc1ccc2ccccc2c1 9ec4203c3d87934793c59750b87a2e85 [0,0,1,0,0,0|3,0,0]=4 47 B17R2.2159 N#CNC(=O)Cc1ccc2ccccc2c1 8aeb7110af7dc4021e7525544fb1ff89 [0,0,1,0,0,0|2,0,1]=4 48 B17R2.5879 BrCCNCCc1ccc2ccccc2c1 e06b4ed50d3b485db43a775f2e69be24 [0,0,1,0,0,0|1,0,1]=3 49 B17R2.5879 C#CCNCCc1ccc2ccccc2c1 96933fc6cb35044646b0c15716184ae0 [0,0,1,0,0,0|1,0,2]=4 50 B17R2.5879 C=CCNCCc1ccc2ccccc2c1 6005fbf7f4c9c2d2330170d50fe04ea0 [0,0,1,0,0,0|1,0,2]=4 51 B17R2.5879 CCCCNCc1ccc2ccccc2c1 050b2005660aa1d3a175504d59c52ce3 [0,0,1,0,0,0|3,0,0]=4 52 B17R2.5879 CCCCOCc1ccc2ccccc2c1 5a90b15dcfce6454cc6974dd861d1fc7 [0,0,1,0,0,0|3,0,0]=4 53 B17R2.5879 CCCNCCc1ccc2ccccc2c1 9a721e34fcd8bd695cc827fe92fb730d [0,0,1,0,0,0|1,0,1]=3 54 B17R2.5879 CCCNCCc1ccc2ccccc2n1 b122ad91ba2fa3f6441136b7ef76a885 [0,0,1,0,0,0|2,0,1]=4 55 B17R2.5879 CCCOCCc1ccc2ccccc2c1 96248411749f9c84e617e2110025d36f [0,0,1,0,0,0|2,0,1]=4 56 B17R2.5879 COCNCCc1ccc2ccccc2c1 68d04d94eba1d0d6100789c28e75b1ff [0,0,1,0,0,0|2,0,1]=4 57 B17R2.5879 CSCNCCc1ccc2ccccc2c1 eb39d3a31b27545461006b1d941c27bd [0,0,1,0,0,0|2,0,1]=4 58 B17R2.5879 ClCCCNCc1ccc2ccccc2c1 a7bdef22f587c5e70a67756ad9a03efd [0,0,1,0,0,0|3,0,0]=4 59 B17R2.5879 FCCCNCc1ccc2ccccc2c1 9d8e63cf0ee2aba029c8c9e9110e1d77 [0,0,1,0,0,0|3,0,0]=4 60 B17R2.5879 FCCCOCc1ccc2ccccc2c1 0c13daf477a2e08fb424cff9cecd76a9 [0,0,1,0,0,0|3,0,0]=4 61 B17R2.5879 FCCNCCc1ccc2ccccc2c1 e9ab49377d40d93d92ddbc911f6ab3c8 [0,0,1,0,0,0|1,0,1]=3 62 B17R2.5879 FCCNCCc1ccc2ccccc2n1 15c4593fb131e26755d90370ea5f734f [0,0,1,0,0,0|2,0,1]=4 63 B17R2.5879 FCCOCCc1ccc2ccccc2c1 19a85628b4e847223160c270d329df65 [0,0,1,0,0,0|2,0,1]=4 64 B17R2.5879 ICCNCCc1ccc2ccccc2c1 b370657713808d3d69c694a024f8130a [0,0,1,0,0,0|1,0,1]=3 65 B17R2.5879 N#CCNCCc1ccc2ccccc2c1 7319237d31551f080c6b982f3d3fa713 [0,0,1,0,0,0|0,0,3]=4 66 B17R2.5879 NOCCNCc1ccc2ccccc2c1 ecbe3b225a03e2f54255116aa445734a [0,0,1,0,0,0|3,0,0]=4 67 B17R2.5879 O=CCNCCc1ccc2ccccc2c1 c79506cf6a4ed59f96c34282bfe8567c [0,0,1,0,0,0|1,0,2]=4 68 B17R2.5879 OCCCNCc1ccc2ccccc2c1 3e2cc664ac1cf13090da1b02288f94ad [0,0,1,0,0,0|3,0,0]=4 69 B17R2.5879 OCCNCCc1ccc2ccccc2c1 d7175c37552688bf1195655382164b64 [0,0,1,0,0,0|1,0,1]=3 70 B17R2.5879 OCCNCCc1ccc2ccccc2n1 6e407c3798cc80f6371a7489e67db53e [0,0,1,0,0,0|2,0,1]=4 71 B17R2.5879 SCCCNCc1ccc2ccccc2c1 3e0568a8fbb44d03b93d19f4664db61b [0,0,1,0,0,0|3,0,0]=4 72 B17R2.5879 SCCCOCc1ccc2ccccc2c1 50eaf2795deded574715e36c1f89679c [0,0,1,0,0,0|3,0,0]=4 73 B17R2.5879 SCCNCCc1ccc2ccccc2c1 36d3cbccca1f164904570486688a0d6f [0,0,1,0,0,0|1,0,1]=3 74 B17R2.5879 SCCNCCc1ccc2ccccc2n1 016ef9a97bc0e4c942c8d93c34b8b228 [0,0,1,0,0,0|2,0,1]=4 75 B17R2.5879 SCCOCCc1ccc2ccccc2c1 afd9043b81702b97d3e510f601c117ca [0,0,1,0,0,0|2,0,1]=4 76 B17R2.48339 CCN(CC)Cc1ccc2ccccc2c1 8607b7c510b1a0b37692ed94057b70d9 [0,0,1,0,0,0|3,0,0]=4 77 B17R3.1917 c1c[nH]c(c1)c2ccc3ccccc3c2 09256c280bfa1a2a35bdbfcfd58fa200 [0,0,0,0,1,0|1,0,2]=4 78 B17R3.1917 c1cc2cc(ccc2cn1)c3ncc[nH]3 80f9aeb8876587e43c765299a4b25538 [0,0,0,0,1,0|1,0,2]=4 79 B17R3.1917 c1cc2ccc(cc2cn1)c3ncc[nH]3 0cb9504a638a77f528e86b68b9c1ad4a [0,0,0,0,1,0|1,0,2]=4 80 B17R3.1917 c1ccc2cc(ccc2c1)c3c[nH]cn3 59336a19232bc9fff9f6377934bdc101 [0,0,0,0,1,0|2,0,1]=4 81 B17R3.1917 c1ccc2cc(ccc2c1)c3c[nH]nn3 016fde8f9b8a8e91db63d7662f386b47 [0,0,0,0,1,0|3,0,0]=4 82 B17R3.1917 c1ccc2cc(ccc2c1)c3cc[nH]n3 5b6224771a34dcfb22994b57dea41d3a [0,0,0,0,1,0|2,0,1]=4 83 B17R3.1917 c1ccc2cc(ccc2c1)c3ccon3 cf2a40c0586287adfe51ffe1aa058106 [0,0,0,0,1,0|2,0,1]=4 84 B17R3.1917 c1ccc2cc(ccc2c1)c3ccsn3 8acc877916198ed38e9ad896e3dc5daa [0,0,0,0,1,0|2,0,1]=4 85 B17R3.1917 c1ccc2cc(ccc2c1)c3cnsn3 3d0875322e37249e9bc4723a35acea4e [0,0,0,0,1,0|3,0,0]=4 86 B17R3.1917 c1ccc2cc(ccc2c1)c3cocn3 182976adb78d2549d209f94a1de83543 [0,0,0,0,1,0|2,0,1]=4 87 B17R3.1917 c1ccc2cc(ccc2c1)c3cscn3 bce298d3b14278e8d0dc1e366f057387 [0,0,0,0,1,0|2,0,1]=4 88 B17R3.1917 c1ccc2cc(ccc2c1)c3csnn3 89f084d60fbecba353b6e352a7e5c10c [0,0,0,0,1,0|3,0,0]=4 89 B17R3.1917 c1ccc2cc(ccc2c1)c3nc[nH]n3 648df236e2431779e780521895f80d75 [0,0,0,0,1,0|1,0,2]=4 90 B17R3.1917 c1ccc2cc(ccc2c1)c3ncc[nH]3 ca00495578509fd6675f081cdb858b67 [0,0,0,0,1,0|0,0,2]=3 91 B17R3.1917 c1ccc2cc(ccc2c1)c3ncco3 b5f6ee7f9b7198d16846da2529026ca8 [0,0,0,0,1,0|1,0,2]=4 92 B17R3.1917 c1ccc2cc(ccc2c1)c3nccs3 df2e80883dbf859e3fa985dfb93d11d6 [0,0,0,0,1,0|1,0,2]=4 93 B17R3.1917 c1ccc2cc(ccc2c1)c3ncns3 eb519a7e205e6cbf2b1ace5934c2a90a [0,0,0,0,1,0|2,0,1]=4 94 B17R3.1917 c1ccc2cc(ccc2c1)c3ncsn3 214878989a0f625fba65d734d0a812d3 [0,0,0,0,1,0|1,0,2]=4 95 B17R3.1917 c1ccc2cc(ccc2c1)c3nn[nH]n3 d0a98110db77dc81b70b07a2c0f1352e [0,0,0,0,1,0|2,0,1]=4 96 B17R3.1917 c1ccc2cc(ccc2c1)c3nnco3 7dde897528378b8b1a3250473aa9752c [0,0,0,0,1,0|2,0,1]=4 97 B17R3.1917 c1ccc2cc(ccc2c1)c3nncs3 b85bb7586509d4f1a26683ba03fe71b7 [0,0,0,0,1,0|2,0,1]=4 98 B17R3.1917 c1ccc2cc(ncc2c1)c3ncc[nH]3 251610eb185c938544c46583450097e7 [0,0,0,0,1,0|1,0,2]=4 99 B17R3.1917 c1ccc2nc(ccc2c1)c3ncc[nH]3 2f2e84638ae897e6d91ebf5fdd3b5e16 [0,0,0,0,1,0|1,0,2]=4 100 B17R3.1917 c1ccc2ncc(cc2c1)c3ncc[nH]3 5c480dfd44e02447b8c1c5939c4b68cb [0,0,0,0,1,0|1,0,2]=4 101 B17R3.1917 c1cnc2cc(ccc2c1)c3ncc[nH]3 a9285aec21a87be3cb9ce2b2f0b11daa [0,0,0,0,1,0|1,0,2]=4 102 B17R3.1917 c1cnc2ccc(cc2c1)c3ncc[nH]3 da863f8150af8f4e2ef362455676834d [0,0,0,0,1,0|1,0,2]=4 103 B17R3.123564 c1cc2cc(ccc2cn1)CN3CCC3 851222ab40277bfaad6a253ceafeaa35 [0,0,0,0,1,0|3,0,0]=4 104 B17R3.123564 c1cc2ccc(cc2cn1)CN3CCC3 ed034b7365a5a9d8a59809617e521bf6 [0,0,0,0,1,0|3,0,0]=4 105 B17R3.123564 c1ccc2cc(ccc2c1)CN3CCC3 bef7ec66d922c703a0682e0086cb01d9 [0,0,0,0,1,0|2,0,0]=3 106 B17R3.123564 c1ccc2cc(ccc2c1)NC3CCC3 0ea8b4426f98d6754e9c9b0158b4171a [0,0,0,0,1,0|2,0,1]=4 107 B17R3.123564 c1ccc2cc(ccc2c1)OC3CCC3 e5887bfe93f8fe9803508227242a2f9b [0,0,0,0,1,0|2,0,1]=4 108 B17R3.123564 c1ccc2cc(ncc2c1)CN3CCC3 71f801f1db0180f4ca5e554d13a6567b [0,0,0,0,1,0|3,0,0]=4 109 B17R3.123564 c1ccc2nc(ccc2c1)CN3CCC3 03acc602be8ef793a5bc30606f037d34 [0,0,0,0,1,0|3,0,0]=4 110 B17R3.123564 c1ccc2ncc(cc2c1)CN3CCC3 a758b84a47c5177c38748dbded40c00c [0,0,0,0,1,0|3,0,0]=4 111 B17R3.123564 c1cnc2ccc(cc2c1)CN3CCC3 61e5f62d5df7d1be25bc3ba44edf2a46 [0,0,0,0,1,0|3,0,0]=4 112 B19R3.19215 c1ccc2cc(ccc2c1)CN3CCCOC3 a0ce4d23f4350d1dd73ffda3a288de62 [0,0,0,0,0,1|3,0,0]=4 113 B19R3.19215 c1ccc2cc(ccc2c1)CN3CCCSC3 315aa189c33c0841eb3e994c2642472b [0,0,0,0,0,1|3,0,0]=4 114 B19R3.19215 c1ccc2cc(ccc2c1)CN3CCOCC3 cb69185a27a037e5bdbff62342900893 [0,0,0,0,0,1|3,0,0]=4 115 B19R3.19215 c1ccc2cc(ccc2c1)CN3CCSCC3 27f99e3b56a9ff4470d88a75b6a03b83 [0,0,0,0,0,1|3,0,0]=4 116 B19R3.62425 C1=C(CCC1)CNc2cc3ccccc3cn2 e5028e6b53b7340672725ac9aa6b01b0 [0,0,0,0,0,1|3,0,0]=4 117 B19R3.62425 C1=C(CCC1)CNc2ccc3ccccc3c2 ef843b3a9061d5905eaa8dc6e23e973c [0,0,0,0,0,1|2,0,0]=3 118 B19R3.62425 C1=C(CCC1)CNc2ccc3ccccc3n2 4bada1c317343a54c93eaef756dc09ae [0,0,0,0,0,1|3,0,0]=4 119 B19R3.62425 C1=C(CCC1)CNc2ccc3cccnc3c2 a73065e05c84e7456eed66d134465fe7 [0,0,0,0,0,1|3,0,0]=4 120 B19R3.62425 C1=C(CCC1)CNc2ccc3ccncc3c2 3bca3be50037a9766cb6a7f0329180ef [0,0,0,0,0,1|3,0,0]=4 121 B19R3.62425 C1=C(CCC1)CNc2ccc3cnccc3c2 93ad491f1e2447ba8d61a9498d40479d [0,0,0,0,0,1|3,0,0]=4 122 B19R3.62425 C1=C(CCC1)CNc2ccc3ncccc3c2 09febe8feddef871d6570d060dde92c2 [0,0,0,0,0,1|3,0,0]=4 123 B19R3.62425 C1=C(CCC1)CNc2cnc3ccccc3c2 6d42094c9a955b59e5fe39eb71843312 [0,0,0,0,0,1|3,0,0]=4 124 B19R3.62425 C1=C(CCC1)COc2cc3ccccc3cn2 0dbad87776981a2c892103e222f8bf29 [0,0,0,0,0,1|3,0,0]=4 125 B19R3.62425 C1=C(CCC1)COc2ccc3ccccc3c2 719b1127adeb5ed2bfa09b332d6fe403 [0,0,0,0,0,1|2,0,0]=3 126 B19R3.62425 C1=C(CCC1)COc2ccc3cccnc3c2 01a10dc0eb4ee5f27b9b6b2139fc118a [0,0,0,0,0,1|3,0,0]=4 127 B19R3.62425 C1=C(CCC1)COc2ccc3ccncc3c2 12ca4f887ed16c48224ef4b43a288bff [0,0,0,0,0,1|3,0,0]=4 128 B19R3.62425 C1=C(CCC1)COc2ccc3cnccc3c2 1b4850690ff42fefd136e6b2f11eb68c [0,0,0,0,0,1|3,0,0]=4 129 B19R3.62425 C1=C(CCC1)COc2ccc3ncccc3c2 7e92acc457099b3008255a1be5b000d8 [0,0,0,0,0,1|3,0,0]=4 130 B19R3.62425 c1c[nH]c(c1)CNc2ccc3ccccc3c2 d9cab061e94d80d9c3f4f2e528f078b5 [0,0,0,0,0,1|1,0,2]=4 131 B19R3.62425 c1cc2cc(ccc2cn1)CNc3ncc[nH]3 e1de89baaeb86f104b0cb408c55e351b [0,0,0,0,0,1|1,0,2]=4 132 B19R3.62425 c1cc2cc(ccc2cn1)NCc3ncc[nH]3 640a1a18f91348eeb6d82ee67ad6ddbf [0,0,0,0,0,1|1,0,2]=4 133 B19R3.62425 c1cc2cc(ccc2cn1)NCc3nnn[nH]3 4ee4297feddc6cc44d1e8bcf80ec7413 [0,0,0,0,0,1|3,0,0]=4 134 B19R3.62425 c1cc2cc(ccc2cn1)OCc3ncc[nH]3 7127948f22f6b6bfe00691f8a3ef7121 [0,0,0,0,0,1|1,0,2]=4 135 B19R3.62425 c1cc2cc(ccc2cn1)OCc3nnn[nH]3 e1ca382b3ce2245d5d4aec8fadc12852 [0,0,0,0,0,1|3,0,0]=4 136 B19R3.62425 c1cc2ccc(cc2cn1)CNc3ncc[nH]3 70ff888b97fb7c3689917b628b40c272 [0,0,0,0,0,1|1,0,2]=4 137 B19R3.62425 c1cc2ccc(cc2cn1)NCc3ncc[nH]3 ec98767510a43821bfa22797b6b4a5c6 [0,0,0,0,0,1|1,0,2]=4 138 B19R3.62425 c1cc2ccc(cc2cn1)NCc3nnn[nH]3 29d006fa3d8a0f83809314b56bb55cf7 [0,0,0,0,0,1|3,0,0]=4 139 B19R3.62425 c1cc2ccc(cc2cn1)OCc3ncc[nH]3 11f28595ab4c6db5ff73a3a684a0b361 [0,0,0,0,0,1|1,0,2]=4 140 B19R3.62425 c1cc2ccc(cc2cn1)OCc3nnn[nH]3 01658dc4530a8d997e876c32510abe9f [0,0,0,0,0,1|3,0,0]=4 141 B19R3.62425 c1ccc2cc(ccc2c1)CNC3CCCC3 b51627c1131d86cce45ba6f9bffe6b14 [0,0,0,0,0,1|2,0,1]=4 142 B19R3.62425 c1ccc2cc(ccc2c1)CNc3c[nH]cn3 264633ef4e19935fd5a74288e2aac351 [0,0,0,0,0,1|2,0,1]=4 143 B19R3.62425 c1ccc2cc(ccc2c1)CNc3c[nH]nn3 b16e3c9627e5c7846cd7124a87ac7b71 [0,0,0,0,0,1|3,0,0]=4 144 B19R3.62425 c1ccc2cc(ccc2c1)CNc3cc[nH]n3 b762ca4e845bf60f1bebf3c5609bd5c3 [0,0,0,0,0,1|2,0,1]=4 145 B19R3.62425 c1ccc2cc(ccc2c1)CNc3ccon3 e46603ac4f7fca6252cedf4bef0fbe4a [0,0,0,0,0,1|2,0,1]=4 146 B19R3.62425 c1ccc2cc(ccc2c1)CNc3ccsn3 b9ecbb2bfa6be76416a705bbb9155fcc [0,0,0,0,0,1|2,0,1]=4 147 B19R3.62425 c1ccc2cc(ccc2c1)CNc3cnon3 4d00f1e3d233a9dc5d8232d72c138631 [0,0,0,0,0,1|3,0,0]=4 148 B19R3.62425 c1ccc2cc(ccc2c1)CNc3cnsn3 0ebae6f094935fade7200815c0a2f022 [0,0,0,0,0,1|3,0,0]=4 149 B19R3.62425 c1ccc2cc(ccc2c1)CNc3cocn3 3db0abbc4ba5f98be4fd10e0cf407fa7 [0,0,0,0,0,1|2,0,1]=4 150 B19R3.62425 c1ccc2cc(ccc2c1)CNc3cscn3 3448900fede100e94fcb4ce8f21a4234 [0,0,0,0,0,1|2,0,1]=4 151 B19R3.62425 c1ccc2cc(ccc2c1)CNc3csnn3 d3dbab0225e28009134440f289dd987c [0,0,0,0,0,1|3,0,0]=4 152 B19R3.62425 c1ccc2cc(ccc2c1)CNc3nc[nH]n3 57f491fa09c4fb72587b5c1f53365fea [0,0,0,0,0,1|1,0,2]=4 153 B19R3.62425 c1ccc2cc(ccc2c1)CNc3ncc[nH]3 091b9c62d9d57aef8a9df73b3ed41c50 [0,0,0,0,0,1|0,0,2]=3 154 B19R3.62425 c1ccc2cc(ccc2c1)CNc3ncco3 98f8379505b63d3e4a76616b8986721f [0,0,0,0,0,1|1,0,2]=4 155 B19R3.62425 c1ccc2cc(ccc2c1)CNc3nccs3 9b14ecf5c171cd2b8bca089e3bc85b65 [0,0,0,0,0,1|1,0,2]=4 156 B19R3.62425 c1ccc2cc(ccc2c1)CNc3ncns3 1ce4e62aa73c91c62db21e514d9a9fd3 [0,0,0,0,0,1|2,0,1]=4 157 B19R3.62425 c1ccc2cc(ccc2c1)CNc3ncon3 92e748a33e444a82acccf8082f2bfafe [0,0,0,0,0,1|1,0,2]=4 158 B19R3.62425 c1ccc2cc(ccc2c1)CNc3ncsn3 e7ded6529cf4448e9deb4f8a12fc76d7 [0,0,0,0,0,1|1,0,2]=4 159 B19R3.62425 c1ccc2cc(ccc2c1)CNc3nn[nH]n3 a56f8ea5aceee5871c86db8891b6bb1e [0,0,0,0,0,1|2,0,1]=4 160 B19R3.62425 c1ccc2cc(ccc2c1)CNc3nnco3 bb105fd5d7ec0a96d559a1f9970f6e34 [0,0,0,0,0,1|2,0,1]=4 161 B19R3.62425 c1ccc2cc(ccc2c1)CNc3nncs3 99ef354a48c2fc7bb9e0aee406d9447b [0,0,0,0,0,1|2,0,1]=4 162 B19R3.62425 c1ccc2cc(ccc2c1)CNc3nnns3 10bac47f5afa42f8cdb4cdc5c8b81cc3 [0,0,0,0,0,1|3,0,0]=4 163 B19R3.62425 c1ccc2cc(ccc2c1)COC3CCCC3 931bf7ec66fa021a1032c1138960e6d3 [0,0,0,0,0,1|2,0,1]=4 164 B19R3.62425 c1ccc2cc(ccc2c1)COC3CCCO3 cace410ab141e26076a93ff1bc8cb94d [0,0,0,0,0,1|2,0,1]=4 165 B19R3.62425 c1ccc2cc(ccc2c1)COc3c[nH]cn3 776d4cb952f27b488343198d30c4f491 [0,0,0,0,0,1|2,0,1]=4 166 B19R3.62425 c1ccc2cc(ccc2c1)COc3ccn[nH]3 584804bd448833ca477b57fd4553fe04 [0,0,0,0,0,1|2,0,1]=4 167 B19R3.62425 c1ccc2cc(ccc2c1)COc3cnsn3 15269f53080cf8e7417b68515bd80aed [0,0,0,0,0,1|3,0,0]=4 168 B19R3.62425 c1ccc2cc(ccc2c1)COc3nccs3 18d680c0c3dd1bc40d62c7dc4f0ec29f [0,0,0,0,0,1|1,0,2]=4 169 B19R3.62425 c1ccc2cc(ccc2c1)COc3nncs3 a0f12cb27d9bb7171f6abfcc54ea536e [0,0,0,0,0,1|2,0,1]=4 170 B19R3.62425 c1ccc2cc(ccc2c1)NCC3CCCC3 1aa4a10744f60f54486ace04e843445b [0,0,0,0,0,1|2,0,1]=4 171 B19R3.62425 c1ccc2cc(ccc2c1)NCC3CCCO3 063b53a2036bf9eb8f453e0bca1e8edd [0,0,0,0,0,1|2,0,1]=4 172 B19R3.62425 c1ccc2cc(ccc2c1)NC[C@@H]3CCCO3 359168128b64516c89246ca28fb67c62 [0,0,0,0,0,1|2,0,1]=4 173 B19R3.62425 c1ccc2cc(ccc2c1)NC[C@H]3CCCO3 433a0d8e21de070ef7fa4ba80cfff1c4 [0,0,0,0,0,1|2,0,1]=4 174 B19R3.62425 c1ccc2cc(ccc2c1)NCc3c[nH]nn3 c7a2d079160018b87f87151724a49184 [0,0,0,0,0,1|3,0,0]=4 175 B19R3.62425 c1ccc2cc(ccc2c1)NCc3ccn[nH]3 92dbf810df5559f8e218a2804b11b350 [0,0,0,0,0,1|2,0,1]=4 176 B19R3.62425 c1ccc2cc(ccc2c1)NCc3ccon3 35937af42958f90b3bc4e94b81cae152 [0,0,0,0,0,1|2,0,1]=4 177 B19R3.62425 c1ccc2cc(ccc2c1)NCc3ccsn3 505dc065f8d389e1a42066f9cfa9c2c2 [0,0,0,0,0,1|2,0,1]=4 178 B19R3.62425 c1ccc2cc(ccc2c1)NCc3cnc[nH]3 3b307ae9745abcc71bfe818ba0d82d48 [0,0,0,0,0,1|2,0,1]=4 179 B19R3.62425 c1ccc2cc(ccc2c1)NCc3cocn3 e8d57ba2c88dfa8ac3cd4f229b2e55e5 [0,0,0,0,0,1|2,0,1]=4 180 B19R3.62425 c1ccc2cc(ccc2c1)NCc3cscn3 f87cf9d1ad75137bd3e7ec38350d20a2 [0,0,0,0,0,1|2,0,1]=4 181 B19R3.62425 c1ccc2cc(ccc2c1)NCc3nc[nH]n3 0f9493e74e7a9775dc90d37aa3cdf032 [0,0,0,0,0,1|1,0,2]=4 182 B19R3.62425 c1ccc2cc(ccc2c1)NCc3ncc[nH]3 cad35aecd9cf1d0e21687999421841db [0,0,0,0,0,1|0,0,2]=3 183 B19R3.62425 c1ccc2cc(ccc2c1)NCc3ncco3 9eadb323dd30447d37b7c83d67fd6f2a [0,0,0,0,0,1|1,0,2]=4 184 B19R3.62425 c1ccc2cc(ccc2c1)NCc3nccs3 16a2c06fc8df48bb7cd7e4a56eec2d9b [0,0,0,0,0,1|1,0,2]=4 185 B19R3.62425 c1ccc2cc(ccc2c1)NCc3ncno3 afff6a9bee4041fcb28ec70f1478a57a [0,0,0,0,0,1|2,0,1]=4 186 B19R3.62425 c1ccc2cc(ccc2c1)NCc3ncon3 31f1b7fbb76c79c004d3f18f722e25d8 [0,0,0,0,0,1|1,0,2]=4 187 B19R3.62425 c1ccc2cc(ccc2c1)NCc3nnco3 7396aa0fa665593407561fe0e8c6d928 [0,0,0,0,0,1|2,0,1]=4 188 B19R3.62425 c1ccc2cc(ccc2c1)NCc3nnn[nH]3 90d892cef71664ea61099e3e20fbb156 [0,0,0,0,0,1|2,0,0]=3 189 B19R3.62425 c1ccc2cc(ccc2c1)OCC3CCCC3 32ab0a8fecd778a8e5a480c9e6bf292f [0,0,0,0,0,1|2,0,1]=4 190 B19R3.62425 c1ccc2cc(ccc2c1)OCC3CCCO3 6197270ea44a2f7036419dd1673faf55 [0,0,0,0,0,1|2,0,1]=4 191 B19R3.62425 c1ccc2cc(ccc2c1)OCc3ccon3 355ce2625e0fd830b2b4a7e247ad97b5 [0,0,0,0,0,1|2,0,1]=4 192 B19R3.62425 c1ccc2cc(ccc2c1)OCc3cnc[nH]3 e5720d168b54fb175d136f04b803c67f [0,0,0,0,0,1|2,0,1]=4 193 B19R3.62425 c1ccc2cc(ccc2c1)OCc3cocn3 dda67acbf12e0fe8a6cd12df062dbc1d [0,0,0,0,0,1|2,0,1]=4 194 B19R3.62425 c1ccc2cc(ccc2c1)OCc3cscn3 19ca36e40aefdba3d9d3c1c9937a8305 [0,0,0,0,0,1|2,0,1]=4 195 B19R3.62425 c1ccc2cc(ccc2c1)OCc3nc[nH]n3 32fc76fed8215759880a0c2ea2d6a862 [0,0,0,0,0,1|1,0,2]=4 196 B19R3.62425 c1ccc2cc(ccc2c1)OCc3ncc[nH]3 989bc052dcc1b45eb71ec02c52de0c02 [0,0,0,0,0,1|0,0,2]=3 197 B19R3.62425 c1ccc2cc(ccc2c1)OCc3ncco3 4400a32019d73a9b5272cee7272c22e2 [0,0,0,0,0,1|1,0,2]=4 198 B19R3.62425 c1ccc2cc(ccc2c1)OCc3nccs3 9cfd77d76d3eabf042053a934c169c2b [0,0,0,0,0,1|1,0,2]=4 199 B19R3.62425 c1ccc2cc(ccc2c1)OCc3ncno3 8b177f2dcd3ba09d36fc81c09fe2641a [0,0,0,0,0,1|2,0,1]=4 200 B19R3.62425 c1ccc2cc(ccc2c1)OCc3ncon3 380dfadfb2b533a88a01896b1d792f28 [0,0,0,0,0,1|1,0,2]=4 201 B19R3.62425 c1ccc2cc(ccc2c1)OCc3nnco3 e22f1b1e1c659177b2d58350680aacc4 [0,0,0,0,0,1|2,0,1]=4 202 B19R3.62425 c1ccc2cc(ccc2c1)OCc3nnn[nH]3 a0a67e7fbddc70d6ebb305c6cdeb8f7c [0,0,0,0,0,1|2,0,0]=3 203 B19R3.62425 c1ccc2cc(ncc2c1)CNc3ncc[nH]3 17e4edef6dc0f91e1a143dc276b63754 [0,0,0,0,0,1|1,0,2]=4 204 B19R3.62425 c1ccc2cc(ncc2c1)NCc3ncc[nH]3 108e9024476d23497f771eec88653dd0 [0,0,0,0,0,1|1,0,2]=4 205 B19R3.62425 c1ccc2cc(ncc2c1)NCc3nnn[nH]3 b0591ac3ab3db5748738a10530081414 [0,0,0,0,0,1|3,0,0]=4 206 B19R3.62425 c1ccc2cc(ncc2c1)OCc3ncc[nH]3 d7f3c1e8982785939e2e9670fa13ab6d [0,0,0,0,0,1|1,0,2]=4 207 B19R3.62425 c1ccc2cc(ncc2c1)OCc3nnn[nH]3 9a7a6bebce382686f4ebe12504e30141 [0,0,0,0,0,1|3,0,0]=4 208 B19R3.62425 c1ccc2nc(ccc2c1)CNc3ncc[nH]3 e0fee305a4221e556e6669e931d57c17 [0,0,0,0,0,1|1,0,2]=4 209 B19R3.62425 c1ccc2nc(ccc2c1)NCc3ncc[nH]3 f6399d4370af6b46a29cc8d499175573 [0,0,0,0,0,1|1,0,2]=4 210 B19R3.62425 c1ccc2nc(ccc2c1)NCc3nnn[nH]3 005b234078662b603041a80a74cc63f2 [0,0,0,0,0,1|3,0,0]=4 211 B19R3.62425 c1ccc2nc(ccc2c1)OCc3ncc[nH]3 d17bd5fd6b83a8276fdf2c50c5a9373f [0,0,0,0,0,1|1,0,2]=4 212 B19R3.62425 c1ccc2nc(ccc2c1)OCc3nnn[nH]3 27cea79a58150edaa9edeebdd6801a19 [0,0,0,0,0,1|3,0,0]=4 213 B19R3.62425 c1ccc2ncc(cc2c1)CNc3ncc[nH]3 4a315a9ce547304752e2c5e60bb4bc63 [0,0,0,0,0,1|1,0,2]=4 214 B19R3.62425 c1ccc2ncc(cc2c1)NCc3ncc[nH]3 f4da8db5f6fc28e04ad55694a397313d [0,0,0,0,0,1|1,0,2]=4 215 B19R3.62425 c1ccc2ncc(cc2c1)NCc3nnn[nH]3 804946bb929885d654f83b5c4af8b535 [0,0,0,0,0,1|3,0,0]=4 216 B19R3.62425 c1ccc2ncc(cc2c1)OCc3ncc[nH]3 28fdf7af56614cbdefa7b6e274dd3d1d [0,0,0,0,0,1|1,0,2]=4 217 B19R3.62425 c1ccc2ncc(cc2c1)OCc3nnn[nH]3 60afcd6aa839d1b1e20bd58e402329e3 [0,0,0,0,0,1|3,0,0]=4 218 B19R3.62425 c1cnc2cc(ccc2c1)NCc3ncc[nH]3 7900bb7f77226987132edef60efec5d2 [0,0,0,0,0,1|1,0,2]=4 219 B19R3.62425 c1cnc2cc(ccc2c1)NCc3nnn[nH]3 a1ee18c95a577ce83a4360b5013ba683 [0,0,0,0,0,1|3,0,0]=4 220 B19R3.62425 c1cnc2cc(ccc2c1)OCc3ncc[nH]3 1ccd79cfd06e0d9be7159ef43f5ddb5b [0,0,0,0,0,1|1,0,2]=4 221 B19R3.62425 c1cnc2cc(ccc2c1)OCc3nnn[nH]3 55a99ab8a56e7f0d5f9b1a3c20f39878 [0,0,0,0,0,1|3,0,0]=4 222 B19R3.62425 c1cnc2ccc(cc2c1)CNc3ncc[nH]3 bb3eedc74969f53d83111fb25f8a590e [0,0,0,0,0,1|1,0,2]=4 223 B19R3.62425 c1cnc2ccc(cc2c1)NCc3ncc[nH]3 e41e35d818296a6eb640d7a69b0c5eb8 [0,0,0,0,0,1|1,0,2]=4 224 B19R3.62425 c1cnc2ccc(cc2c1)NCc3nnn[nH]3 bf89158516e1b2d903296a5895d579cb [0,0,0,0,0,1|3,0,0]=4 225 B19R3.62425 c1cnc2ccc(cc2c1)OCc3ncc[nH]3 790c2cdf20f5fef68b36f40612c12bd9 [0,0,0,0,0,1|1,0,2]=4 226 B19R3.62425 c1cnc2ccc(cc2c1)OCc3nnn[nH]3 34d28b833cf605802f0c7de57224c750 [0,0,0,0,0,1|3,0,0]=4 227 B16R2.2441 BrCCNCc1cc2ccccc2cn1 73569a981a9b48158403625f46b7ec23 [1,0,1,0,0,0|2,0,0]=4 228 B16R2.2441 BrCCNCc1ccc2ccccc2c1 e145a3aec4d4b189c93d4df0c0f186e8 [1,0,1,0,0,0|1,0,0]=3 229 B16R2.2441 BrCCNCc1ccc2ccccc2n1 b433e18d2a5ac48f17aa491fc85f2726 [1,0,1,0,0,0|2,0,0]=4 230 B16R2.2441 BrCCNCc1ccc2ccncc2c1 d333b73bdcc8338add8a244746ce513b [1,0,1,0,0,0|2,0,0]=4 231 B16R2.2441 BrCCNCc1ccc2cnccc2c1 5476722ce60afcdb934fd479ce29ccb8 [1,0,1,0,0,0|2,0,0]=4 232 B16R2.2441 BrCCNCc1ccc2ncccc2c1 c2f50ac7b24053d759ee909d21e856a3 [1,0,1,0,0,0|2,0,0]=4 233 B16R2.2441 BrCCNCc1cnc2ccccc2c1 53c8290659695fa8334e9015129c2f23 [1,0,1,0,0,0|2,0,0]=4 234 B16R2.2441 C#CCNCc1ccc2ccccc2c1 f4a542fdedb309e8dd63276dec549e21 [1,0,1,0,0,0|1,0,1]=4 235 B16R2.2441 C=CCNCc1ccc2ccccc2c1 3da9c4c7824221978e278d07348938cc [1,0,1,0,0,0|1,0,1]=4 236 B16R2.2441 CCCNCc1cc2ccccc2cn1 4c6869363ce04ed2cef5538d4febf732 [1,0,1,0,0,0|2,0,0]=4 237 B16R2.2441 CCCNCc1ccc2ccccc2c1 52da71a9250f73ab838f218a24347eac [1,0,1,0,0,0|1,0,0]=3 238 B16R2.2441 CCCNCc1ccc2ccccc2n1 8b1b6aee973d3c8d49c661d00e7c2ddf [1,0,1,0,0,0|2,0,0]=4 239 B16R2.2441 CCCNCc1ccc2ccncc2c1 6ea999fa8236726321f0520f2a1a450c [1,0,1,0,0,0|2,0,0]=4 240 B16R2.2441 CCCNCc1ccc2cnccc2c1 bf19c015a9a4403eb30136cb11a8bcb9 [1,0,1,0,0,0|2,0,0]=4 241 B16R2.2441 CCCNCc1ccc2ncccc2c1 fff2962d27e3dd3bd36a56eeb5301ebf [1,0,1,0,0,0|2,0,0]=4 242 B16R2.2441 CCCNCc1cnc2ccccc2c1 b396bab4c46e08e203b1701ca9bfe001 [1,0,1,0,0,0|2,0,0]=4 243 B16R2.2441 CCCOCc1ccc2ccccc2c1 a82a8f95759d614ebcc83007813c2de7 [1,0,1,0,0,0|2,0,0]=4 244 B16R2.2441 CCNCCc1ccc2ccccc2c1 b46602817a13caec7a44c990dd3eeeae [1,0,1,0,0,0|0,0,1]=3 245 B16R2.2441 CCNCCc1ccc2ccccc2n1 08e6869e5a195459616022794bbfb72b [1,0,1,0,0,0|1,0,1]=4 246 B16R2.2441 CCOCCc1ccc2ccccc2c1 4a7c9f688d4bc7381d3f2ce48107997b [1,0,1,0,0,0|1,0,1]=4 247 B16R2.2441 COCNCc1ccc2ccccc2c1 ad7b66be1d3bc59935cd0eeffbbabccf [1,0,1,0,0,0|2,0,0]=4 248 B16R2.2441 CSCNCc1ccc2ccccc2c1 f63507782a899fe19362cb0e3ab5169c [1,0,1,0,0,0|2,0,0]=4 249 B16R2.2441 FCCNCc1cc2ccccc2cn1 bdd0729e734ef2dcf78cbe7cd4856edf [1,0,1,0,0,0|2,0,0]=4 250 B16R2.2441 FCCNCc1ccc2ccccc2c1 e1e35d0a30b00378074692f7ae1472d1 [1,0,1,0,0,0|1,0,0]=3 251 B16R2.2441 FCCNCc1ccc2ccccc2n1 5e9f759f4ac603a8754d473bd836bc20 [1,0,1,0,0,0|2,0,0]=4 252 B16R2.2441 FCCNCc1ccc2ccncc2c1 64dd9c026b0a7e568c077851357647a8 [1,0,1,0,0,0|2,0,0]=4 253 B16R2.2441 FCCNCc1ccc2cnccc2c1 edb6d1bedc38f808c0197950afa81ac1 [1,0,1,0,0,0|2,0,0]=4 254 B16R2.2441 FCCNCc1ccc2ncccc2c1 eeff0b662926ee49127414cf155ddc39 [1,0,1,0,0,0|2,0,0]=4 255 B16R2.2441 FCCNCc1cnc2ccccc2c1 af64f35e6412dc802cfc7437b83b398b [1,0,1,0,0,0|2,0,0]=4 256 B16R2.2441 FCCOCc1ccc2ccccc2c1 f3bbb0f9f4da3f09ff72855e4d9134bb [1,0,1,0,0,0|2,0,0]=4 257 B16R2.2441 FCNCCc1ccc2ccccc2c1 425ae74546ec506ff6946b6eb0c0b3fc [1,0,1,0,0,0|1,0,1]=4 258 B16R2.2441 ICCNCc1cc2ccccc2cn1 881bc35d179d6c97514facdabc4bd41e [1,0,1,0,0,0|2,0,0]=4 259 B16R2.2441 ICCNCc1ccc2ccccc2c1 e7703a5ca9a483eea86daa7a2e602088 [1,0,1,0,0,0|1,0,0]=3 260 B16R2.2441 ICCNCc1ccc2ccccc2n1 6adb005614c6038e94ad8b54df04c6c4 [1,0,1,0,0,0|2,0,0]=4 261 B16R2.2441 ICCNCc1ccc2ccncc2c1 8cbdff517ff95c7c0e7cc060b1a1cffd [1,0,1,0,0,0|2,0,0]=4 262 B16R2.2441 ICCNCc1ccc2cnccc2c1 b868bef7a3d3f5789d033d0e597125da [1,0,1,0,0,0|2,0,0]=4 263 B16R2.2441 ICCNCc1ccc2ncccc2c1 31048d88749907a083737431a56c8299 [1,0,1,0,0,0|2,0,0]=4 264 B16R2.2441 ICCNCc1cnc2ccccc2c1 775779622cfc800038e405522b471797 [1,0,1,0,0,0|2,0,0]=4 265 B16R2.2441 N#CCNCc1ccc2ccccc2c1 0b687e74274e812e8cf39bbaedfee8e9 [1,0,1,0,0,0|0,0,2]=4 266 B16R2.2441 O=CCNCc1ccc2ccccc2c1 663c227dfbe2b81c8e7be7877cc6ea2e [1,0,1,0,0,0|1,0,1]=4 267 B16R2.2441 OCCNCc1cc2ccccc2cn1 5c1655a7a2305d48cfea08d0e81e75fd [1,0,1,0,0,0|2,0,0]=4 268 B16R2.2441 OCCNCc1ccc2ccccc2c1 2f054e1607053fe0148da7acefda186a [1,0,1,0,0,0|1,0,0]=3 269 B16R2.2441 OCCNCc1ccc2ccccc2n1 447f7578386da91b9babfa9bb1f49863 [1,0,1,0,0,0|2,0,0]=4 270 B16R2.2441 OCCNCc1ccc2ccncc2c1 d174b856d27647a502e890eabbb9d018 [1,0,1,0,0,0|2,0,0]=4 271 B16R2.2441 OCCNCc1ccc2cnccc2c1 24361cf06a86885825ea207446bfb4ca [1,0,1,0,0,0|2,0,0]=4 272 B16R2.2441 OCCNCc1ccc2ncccc2c1 193bf186516bfc65e3fbe9a5fbb7933d [1,0,1,0,0,0|2,0,0]=4 273 B16R2.2441 OCCNCc1cnc2ccccc2c1 ba734a4d373321d2dc76271644725abf [1,0,1,0,0,0|2,0,0]=4 274 B16R2.2441 OCNCCc1ccc2ccccc2c1 15c43fa510929710683e14c70e380625 [1,0,1,0,0,0|1,0,1]=4 275 B16R2.2441 SCCNCc1cc2ccccc2cn1 f5ab561ab3df0164e8473b9c771ac0cb [1,0,1,0,0,0|2,0,0]=4 276 B16R2.2441 SCCNCc1ccc2ccccc2c1 0f1005e199ed6c8267e62cff39b8f6b4 [1,0,1,0,0,0|1,0,0]=3 277 B16R2.2441 SCCNCc1ccc2ccccc2n1 898db2ba48ce3a56e838065b14d17941 [1,0,1,0,0,0|2,0,0]=4 278 B16R2.2441 SCCNCc1ccc2ccncc2c1 be527e6e17607d44e142c7684910a2bc [1,0,1,0,0,0|2,0,0]=4 279 B16R2.2441 SCCNCc1ccc2cnccc2c1 326ae54af8e4e607f1711ca30e5ebf87 [1,0,1,0,0,0|2,0,0]=4 280 B16R2.2441 SCCNCc1ccc2ncccc2c1 2fc0d3b2c05168d7ca20e79343ed410e [1,0,1,0,0,0|2,0,0]=4 281 B16R2.2441 SCCNCc1cnc2ccccc2c1 f6718c3063a189663ffc49b629e75fca [1,0,1,0,0,0|2,0,0]=4 282 B16R2.2441 SCCOCc1ccc2ccccc2c1 6162facc8fbf5f6771985ad93a02b48c [1,0,1,0,0,0|2,0,0]=4 283 B16R2.5347 CCN(C)Cc1ccc2ccccc2c1 e78607cd767df689e2a1294231b2ec7e [1,0,1,0,0,0|2,0,0]=4 284 B18R2.30019 CCN(C)C(=O)Cc1cc2ccccc2cn1 c3a1a497ed18329cb555d0a7ce8cb090 [0,1,1,0,0,0|2,0,0]=4 285 B18R2.30019 CCN(C)C(=O)Cc1ccc2ccccc2c1 c3d9a8f4f4d5d88a7efc0df6bb98be23 [0,1,1,0,0,0|1,0,0]=3 286 B18R2.30019 CCN(C)C(=O)Cc1ccc2cccnc2c1 cd352db2319c374244e8f34e541fa6e4 [0,1,1,0,0,0|2,0,0]=4 287 B18R2.30019 CCN(C)C(=O)Cc1ccc2cnccc2c1 f2335e84c528eab6469dbe3c85a36d48 [0,1,1,0,0,0|2,0,0]=4 288 B18R2.30019 CCN(C)C(=O)Cc1ccc2ncccc2c1 8a24bde8c47ec5877650813dc13fd57f [0,1,1,0,0,0|2,0,0]=4 289 B18R2.30019 CCN(C)C(=O)Cc1cnc2ccccc2c1 81e8358415255c4194fc98e8c0f8888a [0,1,1,0,0,0|2,0,0]=4 290 B18R2.30019 CCN(C)C(=O)Nc1ccc2ccccc2c1 1b866742ea4713aab61b6e174a50062b [0,1,1,0,0,0|2,0,0]=4 291 B18R2.30019 CCN(C)C(=S)Nc1ccc2ccccc2c1 60bf5157e7df727c585adba1fe89b5b5 [0,1,1,0,0,0|2,0,0]=4 292 B18R2.33945 C#CCNC(=O)Cc1ccc2ccccc2c1 954f47418551c0d49d3aa2fb4780a8c9 [0,1,1,0,0,0|1,0,1]=4 293 B18R2.33945 CCCNC(=O)Cc1cc2ccccc2cn1 97857a664808db78d55bf1744650e02a [0,1,1,0,0,0|2,0,0]=4 294 B18R2.33945 CCCNC(=O)Cc1ccc2ccccc2c1 aa4e0aff0e2b7dbcb56ede28cec496a8 [0,1,1,0,0,0|1,0,0]=3 295 B18R2.33945 CCCNC(=O)Cc1ccc2cccnc2c1 8800de7334c5b733689804deff55b4ef [0,1,1,0,0,0|2,0,0]=4 296 B18R2.33945 CCCNC(=O)Cc1ccc2cnccc2c1 939e0425c0daa650cf0ddf8e75e47b7b [0,1,1,0,0,0|2,0,0]=4 297 B18R2.33945 CCCNC(=O)Cc1ccc2ncccc2c1 f73b4e2abcabd184bf3634f923f8febd [0,1,1,0,0,0|2,0,0]=4 298 B18R2.33945 CCCNC(=O)Cc1cnc2ccccc2c1 375bb8fd2a8647bc808bd763954cb228 [0,1,1,0,0,0|2,0,0]=4 299 B18R2.33945 CCCNC(=O)Nc1ccc2ccccc2c1 5897b083bf56a434126ade97eaf6db47 [0,1,1,0,0,0|2,0,0]=4 300 B18R2.33945 CCCNC(=S)Nc1ccc2ccccc2c1 dd147544a1ac373647f4262f338238fe [0,1,1,0,0,0|2,0,0]=4 301 B18R2.33945 CCNCC(=O)Nc1ccc2ccccc2c1 2d83957d8bc02e96bcbffb2390884498 [0,1,1,0,0,0|2,0,0]=4 302 B18R2.33945 FCCNC(=S)Nc1ccc2ccccc2c1 a8dc7fc9e41af7d6f27fa689a3092957 [0,1,1,0,0,0|2,0,0]=4 303 B18R2.33945 N#CCNC(=O)Cc1ccc2ccccc2c1 21a256c4741f68d28febea9e23d82e9c [0,1,1,0,0,0|1,0,1]=4 304 B18R2.33945 NCCNC(=O)Nc1ccc2ccccc2c1 8fab5406785dc7bdbf362b75e6845aa2 [0,1,1,0,0,0|2,0,0]=4 305 B18R2.33945 NCCNC(=S)Nc1ccc2ccccc2c1 dd4f1113035e6ac46ac15c6cd64bdeb6 [0,1,1,0,0,0|2,0,0]=4 306 B18R2.33945 O=C(Cc1cc2ccccc2cn1)NCCBr d768a400dc86d821cf7145f1a012ef09 [0,1,1,0,0,0|2,0,0]=4 307 B18R2.33945 O=C(Cc1cc2ccccc2cn1)NCCF e09ca4c9d33c9e99fe03bf2de799ba64 [0,1,1,0,0,0|2,0,0]=4 308 B18R2.33945 O=C(Cc1cc2ccccc2cn1)NCCI 26229a995ea34716925d47aa431fbfd2 [0,1,1,0,0,0|2,0,0]=4 309 B18R2.33945 O=C(Cc1cc2ccccc2cn1)NCCO 2bff17f6b8bd39a3dd4596c4944606cc [0,1,1,0,0,0|2,0,0]=4 310 B18R2.33945 O=C(Cc1cc2ccccc2cn1)NCCS 63a4e857df24ec7d3916c64f162f6ed1 [0,1,1,0,0,0|2,0,0]=4 311 B18R2.33945 O=C(Cc1ccc2ccccc2c1)NCCBr cbad41b4b0941b46e13ff53ac4458fea [0,1,1,0,0,0|1,0,0]=3 312 B18R2.33945 O=C(Cc1ccc2ccccc2c1)NCCF 39acb527d4c033d433a5be5c66eec6b9 [0,1,1,0,0,0|1,0,0]=3 313 B18R2.33945 O=C(Cc1ccc2ccccc2c1)NCCI 2097a268c4112d156a99c526fc0ac4c2 [0,1,1,0,0,0|1,0,0]=3 314 B18R2.33945 O=C(Cc1ccc2ccccc2c1)NCCO 1ccdd6079352e77e13224cd9e04cda42 [0,1,1,0,0,0|1,0,0]=3 315 B18R2.33945 O=C(Cc1ccc2ccccc2c1)NCCS f2dbb32a0bcf580c28c00880ad8a698f [0,1,1,0,0,0|1,0,0]=3 316 B18R2.33945 O=C(Cc1ccc2cccnc2c1)NCCBr db1bd5c2111b700738b7aae4a6dda489 [0,1,1,0,0,0|2,0,0]=4 317 B18R2.33945 O=C(Cc1ccc2cccnc2c1)NCCF 7720979bcde8954e242d776020123f9f [0,1,1,0,0,0|2,0,0]=4 318 B18R2.33945 O=C(Cc1ccc2cccnc2c1)NCCI 947d068472d0c393ed14375683b8ea99 [0,1,1,0,0,0|2,0,0]=4 319 B18R2.33945 O=C(Cc1ccc2cccnc2c1)NCCO 3c90c09e46bf5b00b6d6985656466d9a [0,1,1,0,0,0|2,0,0]=4 320 B18R2.33945 O=C(Cc1ccc2cccnc2c1)NCCS 9fcecec1f2cad7ef8a63d1c530c2bf83 [0,1,1,0,0,0|2,0,0]=4 321 B18R2.33945 O=C(Cc1ccc2cnccc2c1)NCCBr 504289e2a4b8cea8e5f0a8d6da1760a7 [0,1,1,0,0,0|2,0,0]=4 322 B18R2.33945 O=C(Cc1ccc2cnccc2c1)NCCF 1e258992cdabda969319fe661003902c [0,1,1,0,0,0|2,0,0]=4 323 B18R2.33945 O=C(Cc1ccc2cnccc2c1)NCCI 345ff58f33d2b005f1189d46b847eca4 [0,1,1,0,0,0|2,0,0]=4 324 B18R2.33945 O=C(Cc1ccc2cnccc2c1)NCCO f6831d99c8560403c5cc4f35cb40ebeb [0,1,1,0,0,0|2,0,0]=4 325 B18R2.33945 O=C(Cc1ccc2cnccc2c1)NCCS c8937fa792cc88b7e0c75df958cbb6e5 [0,1,1,0,0,0|2,0,0]=4 326 B18R2.33945 O=C(Cc1ccc2ncccc2c1)NCCBr a5c87048cd5be4f13f6c6a12105bc87e [0,1,1,0,0,0|2,0,0]=4 327 B18R2.33945 O=C(Cc1ccc2ncccc2c1)NCCF b344b9290e1f2d0ef8a9a1de9a8d30ac [0,1,1,0,0,0|2,0,0]=4 328 B18R2.33945 O=C(Cc1ccc2ncccc2c1)NCCI debc89ea7da387e92b16b69a524c2bf1 [0,1,1,0,0,0|2,0,0]=4 329 B18R2.33945 O=C(Cc1ccc2ncccc2c1)NCCO 5dd4d605062cc20a82f3a705176b3a78 [0,1,1,0,0,0|2,0,0]=4 330 B18R2.33945 O=C(Cc1ccc2ncccc2c1)NCCS 538ca0421835af5b200078e001c03bed [0,1,1,0,0,0|2,0,0]=4 331 B18R2.33945 O=C(Cc1cnc2ccccc2c1)NCCBr 4773f03932a363759d96128b26f29e49 [0,1,1,0,0,0|2,0,0]=4 332 B18R2.33945 O=C(Cc1cnc2ccccc2c1)NCCF 967b27039232a15c05dbf88b25a35218 [0,1,1,0,0,0|2,0,0]=4 333 B18R2.33945 O=C(Cc1cnc2ccccc2c1)NCCI af4eac79da8b5a5e916049260062e7cd [0,1,1,0,0,0|2,0,0]=4 334 B18R2.33945 O=C(Cc1cnc2ccccc2c1)NCCO be00849a8b0280dff84e15b539c63be9 [0,1,1,0,0,0|2,0,0]=4 335 B18R2.33945 O=C(Cc1cnc2ccccc2c1)NCCS 0851d232935f36b6bd75a78d0446912d [0,1,1,0,0,0|2,0,0]=4 336 B18R2.33945 OCCNC(=S)Nc1ccc2ccccc2c1 964cf8af0c748671b53e007cc98bcb5c [0,1,1,0,0,0|2,0,0]=4 337 B18R2.33945 S=C(NCCS)Nc1ccc2ccccc2c1 79ffceff9d9431000b6d453a9e31408d [0,1,1,0,0,0|2,0,0]=4 338 B18R2.125209 CCNC(CO)Cc1ccc2ccccc2c1 566cd0b9b2101e8f76241d686b7276c5 [0,1,1,0,0,0|1,0,1]=4 339 B18R2.584300 CCNC(C)(C)Cc1ccc2ccccc2c1 911b972bbd24d6fff9e5d12bc0916690 [0,1,1,0,0,0|1,0,1]=4 340 B18R2.2397 CCCNCC(O)c1ccc2ccccc2c1 d145140a1006725c925b4f92c0d56b0c [0,1,1,0,0,0|1,0,1]=4 341 B18R2.2397 OC(CNCCF)c1ccc2ccccc2c1 eaed5b40967eaa747e98ba9ef5fca494 [0,1,1,0,0,0|1,0,1]=4 342 B18R2.2397 OC(CNCCS)c1ccc2ccccc2c1 1959db831b42fcde320777253017f594 [0,1,1,0,0,0|1,0,1]=4 343 B18R2.2397 OCCNCC(O)c1ccc2ccccc2c1 4e50c943fc8c50b9202a0741b5fb30f6 [0,1,1,0,0,0|1,0,1]=4 344 B18R2.8085 CCCN(C)CCc1ccc2ccccc2c1 9ddc145f4e4ba6ec97ff05afee6f4851 [0,1,1,0,0,0|1,0,1]=4 345 B18R2.8085 CN(CCF)CCc1ccc2ccccc2c1 82213ac61dd8dad6faa57a0460f477bf [0,1,1,0,0,0|1,0,1]=4 346 B18R2.8085 CN(CCO)CCc1ccc2ccccc2c1 daa46100ae8da6898c5ca567d0eebd4a [0,1,1,0,0,0|1,0,1]=4 347 B18R2.9469 CC(CO)NCCc1ccc2ccccc2c1 5aade436cbafd5cb3f8ea604b332ba82 [0,1,1,0,0,0|1,0,1]=4 348 B18R2.9469 CCC(C)NCCc1ccc2ccccc2c1 f415ad2b4ddfda2befd1d4cdc5c9afc0 [0,1,1,0,0,0|1,0,1]=4 349 B18R2.9469 CC[C@@H](C)NCCc1ccc2ccccc2c1 fc1cb68191c7c5fa8c34b9801d5294a8 [0,1,1,0,0,0|1,0,1]=4 350 B18R2.9469 CC[C@H](C)NCCc1ccc2ccccc2c1 c71e97ec503f2355f1039c9d61541a05 [0,1,1,0,0,0|1,0,1]=4 351 B18R2.9469 C[C@@H](CO)NCCc1ccc2ccccc2c1 477bf68ecb0d870f4590b9e28c2b2b3d [0,1,1,0,0,0|1,0,1]=4 352 B18R2.9469 C[C@H](CO)NCCc1ccc2ccccc2c1 30e2401683b97927e83b9f168e4cc3d1 [0,1,1,0,0,0|1,0,1]=4 353 B18R2.9737 BrCCNCCOc1ccc2ccccc2c1 4e5e992d2ad477965a0b98b4b18f851f [0,1,1,0,0,0|1,0,1]=4 354 B18R2.9737 BrCCNCOCc1ccc2ccccc2c1 40349650df487b6b38b4482381622a15 [0,1,1,0,0,0|1,0,1]=4 355 B18R2.9737 C#CCCNCCc1ccc2ccccc2c1 5475ef4e338c87b13f84ee793b6e1442 [0,1,1,0,0,0|1,0,1]=4 356 B18R2.9737 C=CCCNCCc1ccc2ccccc2c1 6a1644c471f7f422d6328e55b2ec3d29 [0,1,1,0,0,0|1,0,1]=4 357 B18R2.9737 CCC/C=C/CNc1ccc2ccccc2c1 c02474da3c4c86a9850d3f63e27710ba [0,1,1,0,0,0|2,0,0]=4 358 B18R2.9737 CCC/C=C/COc1ccc2ccccc2c1 d47d15c488b660efdcae22d2ab568273 [0,1,1,0,0,0|2,0,0]=4 359 B18R2.9737 CCC/C=C\CNc1ccc2ccccc2c1 4d1b60dd805ae52b8327de71eceb7d45 [0,1,1,0,0,0|2,0,0]=4 360 B18R2.9737 CCC/C=C\COc1ccc2ccccc2c1 38d4e4ddad18bba8a34cf31f133240d7 [0,1,1,0,0,0|2,0,0]=4 361 B18R2.9737 CCCCNCCc1ccc2ccccc2c1 e7af1dfb07a15a4fb843d3223218b821 [0,1,1,0,0,0|1,0,1]=4 362 B18R2.9737 CCCNCCCc1ccc2ccccc2c1 320dc7b1372b1c2327bae70b92106f30 [0,1,1,0,0,0|1,0,1]=4 363 B18R2.9737 CCCNCCOc1ccc2ccccc2c1 99f28ed36658a2e8bbf7cfbc70e749f6 [0,1,1,0,0,0|1,0,1]=4 364 B18R2.9737 CCOCNCCc1ccc2ccccc2c1 696c23ee02517896945bf44e7b771d5f [0,1,1,0,0,0|1,0,1]=4 365 B18R2.9737 COCCNCCc1ccc2ccccc2c1 df48cf7053df24afe81e5272ab136f05 [0,1,1,0,0,0|1,0,1]=4 366 B18R2.9737 CSCCNCCc1ccc2ccccc2c1 906895449fdfcf03a561d9d42bc28c32 [0,1,1,0,0,0|1,0,1]=4 367 B18R2.9737 ClCCCNCCc1ccc2ccccc2c1 3b669d5b0a35bdc1b3e01a6d2626f437 [0,1,1,0,0,0|1,0,1]=4 368 B18R2.9737 FCCCNCCc1ccc2ccccc2c1 d9a77308a55d39f92f4433ab3631573c [0,1,1,0,0,0|1,0,1]=4 369 B18R2.9737 FCCNCCCc1ccc2ccccc2c1 96fd99e4646af5c3bad9a0c3f79a128d [0,1,1,0,0,0|1,0,1]=4 370 B18R2.9737 FCCNCCOc1ccc2ccccc2c1 88cf62f235d5f36f6a19c1a0b26b33ac [0,1,1,0,0,0|1,0,1]=4 371 B18R2.9737 ICCNCCOc1ccc2ccccc2c1 12dbe64ed91cb8dd5c749fd82b506a31 [0,1,1,0,0,0|1,0,1]=4 372 B18R2.9737 N#CCCNCCc1ccc2ccccc2c1 cfc4c928224881aa84a20639625b4749 [0,1,1,0,0,0|0,0,2]=4 373 B18R2.9737 NOCCNCCc1ccc2ccccc2c1 1447b9eac9af02a327c710c6134183ee [0,1,1,0,0,0|0,0,2]=4 374 B18R2.9737 O=CCCNCCc1ccc2ccccc2c1 bfc8df229104d515f17d52db2c5e7918 [0,1,1,0,0,0|1,0,1]=4 375 B18R2.9737 OCCCNCCc1ccc2ccccc2c1 ddffa0e1b2c2d770ddf97274472f8077 [0,1,1,0,0,0|1,0,1]=4 376 B18R2.9737 OCCNCCCc1ccc2ccccc2c1 e8daf4475ca6a4f90c717feb491c6403 [0,1,1,0,0,0|1,0,1]=4 377 B18R2.9737 OCCNCCOc1ccc2ccccc2c1 0dbd551454e44b424b25255356e2d4f0 [0,1,1,0,0,0|1,0,1]=4 378 B18R2.9737 OCCNCOCc1ccc2ccccc2c1 ab4f6486b399841fdc112c79f2cdf0e8 [0,1,1,0,0,0|1,0,1]=4 379 B18R2.9737 SCCCNCCc1ccc2ccccc2c1 5c72461ad6d808cb62d39a39f8b4ec29 [0,1,1,0,0,0|1,0,1]=4 380 B18R2.9737 SCCNCCCc1ccc2ccccc2c1 5dd58a079ce28128a029c1a5bb334cb5 [0,1,1,0,0,0|1,0,1]=4 381 B18R2.9737 SCCNCCOc1ccc2ccccc2c1 b868b6cc3caa987ae9f3efbcce250e99 [0,1,1,0,0,0|1,0,1]=4 382 B18R2.9909 CC(C)CNCCc1ccc2ccccc2c1 07a81509e0fdf88507c18603f32aa6c1 [0,1,1,0,0,0|1,0,1]=4 383 B18R2.9909 CC(O)CNCCc1ccc2ccccc2c1 f9d0fbaa4ce6290bfce5e3e43175a19b [0,1,1,0,0,0|1,0,1]=4 384 B18R2.9909 C[C@@H](O)CNCCc1ccc2ccccc2c1 6644bc1d1ca8e612986d1775547923a1 [0,1,1,0,0,0|1,0,1]=4 385 B18R2.9909 C[C@H](O)CNCCc1ccc2ccccc2c1 6119ede384a1229fabc545d01b73b4e2 [0,1,1,0,0,0|1,0,1]=4 386 B18R2.9909 FC(F)CNCCc1ccc2ccccc2c1 1450736f457a88e56321ba246795280f [0,1,1,0,0,0|1,0,1]=4 387 B18R3.2942 Cc1c[nH]c(n1)c2ccc3ccccc3c2 639a88643a65571ec035d9e2201d3045 [0,1,0,0,1,0|0,0,2]=4 388 B18R3.2942 Nc1n[nH]c(n1)c2ccc3ccccc3c2 8b90e0ec836bce85eb10d8aca4761c47 [0,1,0,0,1,0|1,0,1]=4 389 B18R3.3053 Brc1ccc2ccc(cc2c1)c3ncc[nH]3 8ccc94d6e44a4bbb24f34aa2cd7c4c72 [0,1,0,0,1,0|0,0,2]=4 390 B18R3.3053 Cc1ccc2ccc(cc2c1)c3ncc[nH]3 81f8e75984421c4d0b54d586296d8ffa [0,1,0,0,1,0|0,0,2]=4 391 B18R3.3053 Clc1ccc2ccc(cc2c1)c3ncc[nH]3 154601013d8d6975b523c685b790e20a [0,1,0,0,1,0|0,0,2]=4 392 B18R3.3053 Nc1ccc2ccc(cc2c1)c3ncc[nH]3 43e739c7860285a47b06315858a858bd [0,1,0,0,1,0|0,0,2]=4 393 B18R3.3053 Oc1ccc2ccc(cc2c1)c3ncc[nH]3 9f0797099cbbc7a31533924cd6966c06 [0,1,0,0,1,0|0,0,2]=4 394 B18R3.3824 Cn1ccnc1c2ccc3ccccc3c2 b1de36de78d860de0ae20d6bc21b1a2b [0,1,0,0,1,0|0,0,2]=4 395 B18R3.3824 Cn1cnnc1c2ccc3ccccc3c2 10b92047079b4292628d2bcf9843ad84 [0,1,0,0,1,0|1,0,1]=4 396 B18R3.3824 Cn1ncnc1c2ccc3ccccc3c2 847f3c1837af37e80839badc5a483d31 [0,1,0,0,1,0|1,0,1]=4 397 B18R3.3824 Cn1nnnc1c2ccc3ccccc3c2 c86a83832d08bb935ea1be40d970c7a1 [0,1,0,0,1,0|2,0,0]=4 398 B18R3.4383 Cc1c(ccc2c1cccc2)c3ncc[nH]3 d146f8fe61d985e53747e0da80d1561c [0,1,0,0,1,0|0,0,2]=4 399 B18R3.4383 Fc1c(ccc2c1cccc2)c3ncc[nH]3 9650b147af061956257ee9bbe8c362ed [0,1,0,0,1,0|0,0,2]=4 400 B18R3.4383 Nc1c(ccc2c1cccc2)c3ncc[nH]3 4f4264de9fbb2b08f11c3f08b5c513e0 [0,1,0,0,1,0|0,0,2]=4 401 B18R3.4383 Oc1c(ccc2c1cccc2)c3ncc[nH]3 30a86c6497db5e8b612e69d927bcff6b [0,1,0,0,1,0|0,0,2]=4 402 B18R3.5872 Nc1cccc2c1ccc(c2)c3ncc[nH]3 ed9899dc5e61874a4861160b5ee225fa [0,1,0,0,1,0|0,0,2]=4 403 B18R3.5872 Oc1cccc2c1ccc(c2)c3ncc[nH]3 cc50ec6459ae10c1348525dee39c77c7 [0,1,0,0,1,0|0,0,2]=4 404 B18R3.6367 Brc1cc2ccccc2cc1c3ncc[nH]3 0a81dbe4999cf8ea3901ea7ea8816ece [0,1,0,0,1,0|0,0,2]=4 405 B18R3.6367 Cc1cc2ccccc2cc1c3ncc[nH]3 9b0c014e1447e5077bd14478be51e867 [0,1,0,0,1,0|0,0,2]=4 406 B18R3.6367 Clc1cc2ccccc2cc1c3ncc[nH]3 c31ff357dc4b3f3dcaec6a3f91c245e9 [0,1,0,0,1,0|0,0,2]=4 407 B18R3.6367 Fc1cc2ccccc2cc1c3ncc[nH]3 90289d4b5037f9af33e9ff71e7d8260f [0,1,0,0,1,0|0,0,2]=4 408 B18R3.6367 Nc1cc2ccccc2cc1c3ncc[nH]3 05e04b27bff9073445a079de03b86682 [0,1,0,0,1,0|0,0,2]=4 409 B18R3.6367 Oc1cc2ccccc2cc1c3ncc[nH]3 cd483575e44449dfc348ad944150d916 [0,1,0,0,1,0|0,0,2]=4 410 B18R3.6548 Nc1cc(cc2c1cccc2)c3ncc[nH]3 73910008d7c0a8dbbc5088fc82503c0a [0,1,0,0,1,0|0,0,2]=4 411 B18R3.51705 Brc1ccc2cc(ccc2c1)c3ncc[nH]3 ffa7db07db8ef4ca2d719194b36916df [0,1,0,0,1,0|0,0,2]=4 412 B18R3.51705 Cc1ccc2cc(ccc2c1)c3ncc[nH]3 cd83a40295bd31eb8539dff2e762242c [0,1,0,0,1,0|0,0,2]=4 413 B18R3.51705 Clc1ccc2cc(ccc2c1)c3ncc[nH]3 aa3041cfced509dd67b13ca2b8b8e5f1 [0,1,0,0,1,0|0,0,2]=4 414 B18R3.51705 Fc1ccc2cc(ccc2c1)c3ncc[nH]3 fbe548a21c3a49edfb2e5391be0a6844 [0,1,0,0,1,0|0,0,2]=4 415 B18R3.51705 Nc1ccc2cc(ccc2c1)c3ncc[nH]3 b66fdf471d3f79b5e8d2fed78b72b38c [0,1,0,0,1,0|0,0,2]=4 416 B18R3.51705 Oc1ccc2cc(ccc2c1)c3ncc[nH]3 d4dc44d5f480955616630e86b9b52839 [0,1,0,0,1,0|0,0,2]=4 417 B18R3.89733 Cc1cccc2c1cc(cc2)c3ncc[nH]3 1566f84060d295ecf2cce6ab83405e68 [0,1,0,0,1,0|0,0,2]=4 418 B18R3.89733 Nc1cccc2c1cc(cc2)c3ncc[nH]3 b12a7ce389689e968d59d7e895356acd [0,1,0,0,1,0|0,0,2]=4 419 B18R3.89733 Oc1cccc2c1cc(cc2)c3ncc[nH]3 2b0049426af35025639aaaf01fc32feb [0,1,0,0,1,0|0,0,2]=4 420 B18R3.32120 Brc1ccc2ccc(cc2c1)CN3CCC3 35aab303b34fc7d0158a3dd3257b8661 [0,1,0,0,1,0|2,0,0]=4 421 B18R3.55121 FC1CN(C1)Cc2ccc3ccccc3c2 20d552a65b39703436fd3c171688de7f [0,1,0,0,1,0|2,0,0]=4 422 B18R3.55121 OC1CN(C1)Cc2ccc3ccccc3c2 31d322dc1414f9d0f2ad8242c511b425 [0,1,0,0,1,0|2,0,0]=4 423 B18R3.100898 Brc1cc(cc2c1cccc2)CN3CCC3 b6d683e709d1858717e7148c63a786e1 [0,1,0,0,1,0|2,0,0]=4 424 B18R3.100898 Clc1cc(cc2c1cccc2)CN3CCC3 4c925801edf62be20752316faf05e760 [0,1,0,0,1,0|2,0,0]=4 425 B18R3.405767 Brc1ccc2cc(ccc2c1)CN3CCC3 1d082233c70d406751d20cb00aff874c [0,1,0,0,1,0|2,0,0]=4 426 B18R3.422385 Brc1c(ccc2c1cccc2)CN3CCC3 9be05ea212fc077ceb747a8c5d8f8fb5 [0,1,0,0,1,0|2,0,0]=4 427 B20R3.12812 Brc1cc2ccccc2cc1NCC3=CCCC3 24d034ccb00d245c7d398d24e9b22935 [0,1,0,0,0,1|2,0,0]=4 428 B20R3.12812 Brc1cc2ccccc2cc1NCc3ncc[nH]3 73d440965315cee872c1dbe52681d1e0 [0,1,0,0,0,1|0,0,2]=4 429 B20R3.12812 Brc1cc2ccccc2cc1NCc3nnn[nH]3 422fcd163bd482befc85d4dcf83d4dec [0,1,0,0,0,1|2,0,0]=4 430 B20R3.12812 Brc1cc2ccccc2cc1OCC3=CCCC3 d55fede4aa201eba25d27c58de43fefa [0,1,0,0,0,1|2,0,0]=4 431 B20R3.12812 Brc1cc2ccccc2cc1OCc3ncc[nH]3 a207deb8ccf1da4c0f85b35add8d1857 [0,1,0,0,0,1|0,0,2]=4 432 B20R3.12812 Brc1cc2ccccc2cc1OCc3nnn[nH]3 31983a6b9ecc1ae5e3e7dffe8d09e7a7 [0,1,0,0,0,1|2,0,0]=4 433 B20R3.12812 Cc1cc2ccccc2cc1NCc3ncc[nH]3 1e66d63e66276cdcabbbf2077d46698f [0,1,0,0,0,1|0,0,2]=4 434 B20R3.12812 Cc1cc2ccccc2cc1NCc3ncn[nH]3 b785ebb5315fb7582dde1d64acac9813 [0,1,0,0,0,1|1,0,1]=4 435 B20R3.12812 Cc1cc2ccccc2cc1OCc3ncc[nH]3 5f47aaece0a1fad5efa167076edb6c2a [0,1,0,0,0,1|0,0,2]=4 436 B20R3.12812 Cc1cc2ccccc2cc1OCc3nnn[nH]3 40ace0f20920437a7bcf228d82efd566 [0,1,0,0,0,1|2,0,0]=4 437 B20R3.12812 Clc1cc2ccccc2cc1NCC3=CCCC3 523d7022cca85b21f39cc6393158ab25 [0,1,0,0,0,1|2,0,0]=4 438 B20R3.12812 Clc1cc2ccccc2cc1NCc3ncc[nH]3 5d7c8230331a4c79d2e1473da21afc87 [0,1,0,0,0,1|0,0,2]=4 439 B20R3.12812 Clc1cc2ccccc2cc1NCc3nnn[nH]3 d8feea61789d4738d2343e27a7d4563e [0,1,0,0,0,1|2,0,0]=4 440 B20R3.12812 Clc1cc2ccccc2cc1OCC3=CCCC3 21314e151f9d4e84f8db7a40410fbf3a [0,1,0,0,0,1|2,0,0]=4 441 B20R3.12812 Clc1cc2ccccc2cc1OCc3ncc[nH]3 8eb01889718589da075b89f32fa881ba [0,1,0,0,0,1|0,0,2]=4 442 B20R3.12812 Clc1cc2ccccc2cc1OCc3nnn[nH]3 566df874cbe2196ea76f8ecfe384d5fe [0,1,0,0,0,1|2,0,0]=4 443 B20R3.12812 Fc1cc2ccccc2cc1NCC3=CCCC3 4d2c68c789523ebc23ab5c0abb256296 [0,1,0,0,0,1|2,0,0]=4 444 B20R3.12812 Fc1cc2ccccc2cc1NCc3ncc[nH]3 cc066d32b1a125f212a1425e9d8b1369 [0,1,0,0,0,1|0,0,2]=4 445 B20R3.12812 Fc1cc2ccccc2cc1NCc3nnn[nH]3 4d68647a21277db9df76a27b39cb1591 [0,1,0,0,0,1|2,0,0]=4 446 B20R3.12812 Fc1cc2ccccc2cc1OCC3=CCCC3 ce4cc6255fd3b49cec625683f148c30a [0,1,0,0,0,1|2,0,0]=4 447 B20R3.12812 Fc1cc2ccccc2cc1OCc3ncc[nH]3 1420e01971042b49e294ce304e881aae [0,1,0,0,0,1|0,0,2]=4 448 B20R3.12812 Fc1cc2ccccc2cc1OCc3nnn[nH]3 0d15804c42d9eaeffd0ed9d24849d39b [0,1,0,0,0,1|2,0,0]=4 449 B20R3.12812 Ic1cc2ccccc2cc1NCC3=CCCC3 0950f97c66aba0f68d2a4106e15ca56d [0,1,0,0,0,1|2,0,0]=4 450 B20R3.12812 Ic1cc2ccccc2cc1NCc3ncc[nH]3 8a4604a9d01065f557b754c9a27e8b9b [0,1,0,0,0,1|0,0,2]=4 451 B20R3.12812 Ic1cc2ccccc2cc1NCc3nnn[nH]3 265eb147081c0681e18003b35a2fd3d0 [0,1,0,0,0,1|2,0,0]=4 452 B20R3.12812 Oc1cc2ccccc2cc1CNc3ncc[nH]3 c64f1f123f413e7cd5492385075f30f1 [0,1,0,0,0,1|0,0,2]=4 453 B20R3.12812 Oc1cc2ccccc2cc1NCc3ncn[nH]3 a2cfb843828f28dc44e2a42cc4c30eb1 [0,1,0,0,0,1|1,0,1]=4 454 B20R3.16123 CN(Cc1ccc2ccccc2c1)c3ncc[nH]3 3051f994ca066f78de5ea176adaceeeb [0,1,0,0,0,1|0,0,2]=4 455 B20R3.16123 CN(Cc1ccc2ccccc2c1)c3nnc[nH]3 b0ed9998fbe063e74980a3cee5cb59a7 [0,1,0,0,0,1|1,0,1]=4 456 B20R3.86130 Brc1c[nH]c(n1)NCc2ccc3ccccc3c2 8499e6938d6650e800f6704547b49042 [0,1,0,0,0,1|0,0,2]=4 457 B20R3.86130 Brc1n[nH]c(n1)OCc2ccc3ccccc3c2 8d51ee30e59f545a272f5900e449e8e6 [0,1,0,0,0,1|1,0,1]=4 458 B20R3.86130 Cc1cnc([nH]1)NCc2ccc3ccccc3c2 21f136b325380740da54ded1fc54b36e [0,1,0,0,0,1|0,0,2]=4 459 B20R3.86130 Cc1n[nH]c(n1)NCc2ccc3ccccc3c2 6f4cccdedd7ae7e701b6ab33dfa200c1 [0,1,0,0,0,1|1,0,1]=4 460 B20R3.86130 Clc1n[nH]c(n1)NCc2ccc3ccccc3c2 1d87e8193539cdd40fc4e5dce3f1b9d5 [0,1,0,0,0,1|1,0,1]=4 461 B20R3.86130 O=c1[nH]c(no1)NCc2ccc3ccccc3c2 262b36c907ca8d955a63af948f68acef [0,1,0,0,0,1|1,0,1]=4 462 B20R3.86130 O=c1[nH]nc([nH]1)COc2ccc3ccccc3c2 ce9a8eec39b2b36c04a11c7600a36f71 [0,1,0,0,0,1|1,0,1]=4 463 B20R3.86130 O=c1[nH]nc([nH]1)NCc2ccc3ccccc3c2 bc3742ad83dea8841e4be565bcccbc40 [0,1,0,0,0,1|1,0,1]=4 464 B20R3.92961 Brc1ccc2ccc(cc2c1)CNc3ncc[nH]3 fed746bb44bb7be24a91ad5f858fa7da [0,1,0,0,0,1|0,0,2]=4 465 B20R3.92961 Brc1ccc2ccc(cc2c1)NCC3=CCCC3 9f55a80901a179d459bd9da79d246bf4 [0,1,0,0,0,1|2,0,0]=4 466 B20R3.92961 Brc1ccc2ccc(cc2c1)NCc3ncc[nH]3 c5ce97ad3298e11ecfb3fbc66817a7f3 [0,1,0,0,0,1|0,0,2]=4 467 B20R3.92961 Brc1ccc2ccc(cc2c1)NCc3nnn[nH]3 e5d23d907f18fb932d528f7ae3a9fe4a [0,1,0,0,0,1|2,0,0]=4 468 B20R3.92961 Brc1ccc2ccc(cc2c1)OCc3ncc[nH]3 9e9f554d570ed54406f6ba0b01f40baa [0,1,0,0,0,1|0,0,2]=4 469 B20R3.92961 Brc1ccc2ccc(cc2c1)OCc3nnn[nH]3 477556a884ec628362a6d93d10a91e07 [0,1,0,0,0,1|2,0,0]=4 470 B20R3.92961 Cc1ccc2ccc(cc2c1)NCC3=CCCC3 45d9f7a361b1c8c1f721d77834d65e57 [0,1,0,0,0,1|2,0,0]=4 471 B20R3.92961 Cc1ccc2ccc(cc2c1)NCc3ncc[nH]3 8279cce510a3258ef83ef85d4ff4f3b6 [0,1,0,0,0,1|0,0,2]=4 472 B20R3.92961 Cc1ccc2ccc(cc2c1)NCc3nnn[nH]3 6631eada4dc0f18e1b4b6221a2322db5 [0,1,0,0,0,1|2,0,0]=4 473 B20R3.92961 Cc1ccc2ccc(cc2c1)OCc3ncc[nH]3 888b96007e44dc653af89775c350525b [0,1,0,0,0,1|0,0,2]=4 474 B20R3.92961 Cc1ccc2ccc(cc2c1)OCc3nnn[nH]3 9f50180bb139ce332049edf94047559d [0,1,0,0,0,1|2,0,0]=4 475 B20R3.92961 Clc1ccc2ccc(cc2c1)OCC3=CCCC3 a732b022376548f89b88bcfcfdf55797 [0,1,0,0,0,1|2,0,0]=4 476 B20R3.92961 Clc1ccc2ccc(cc2c1)OCc3ncc[nH]3 20db6068330b88c44f0f59337a72de62 [0,1,0,0,0,1|0,0,2]=4 477 B20R3.92961 Clc1ccc2ccc(cc2c1)OCc3nnn[nH]3 8506413edb0590cbe5a150c374250344 [0,1,0,0,0,1|2,0,0]=4 478 B20R3.92961 Fc1ccc2ccc(cc2c1)OCC3=CCCC3 c64e3b8a901cd25d79a9858042fc2aaa [0,1,0,0,0,1|2,0,0]=4 479 B20R3.92961 Fc1ccc2ccc(cc2c1)OCc3ncc[nH]3 1c6c1ecd3516ce6fb8432f6528456735 [0,1,0,0,0,1|0,0,2]=4 480 B20R3.92961 Fc1ccc2ccc(cc2c1)OCc3nnn[nH]3 30241d8273420d60500f8bf0850e4428 [0,1,0,0,0,1|2,0,0]=4 481 B20R3.92961 Oc1ccc2ccc(cc2c1)NCc3ncc[nH]3 2bff9ed4827c2852da7af787f59e17b9 [0,1,0,0,0,1|0,0,2]=4 482 B20R3.93114 Brc1ccc2cc(ccc2c1)CNc3ncc[nH]3 b5f087a9445fcecdffd1ec1aefeef0a2 [0,1,0,0,0,1|0,0,2]=4 483 B20R3.93114 Brc1ccc2cc(ccc2c1)NCC3=CCCC3 fddde4234aa31de2139a8291ee8f89c2 [0,1,0,0,0,1|2,0,0]=4 484 B20R3.93114 Brc1ccc2cc(ccc2c1)NCc3ncc[nH]3 b46821d812373de964d4833cfd2cd64c [0,1,0,0,0,1|0,0,2]=4 485 B20R3.93114 Brc1ccc2cc(ccc2c1)NCc3nnn[nH]3 76104676329e0b1ef2a7ee1db3ca589b [0,1,0,0,0,1|2,0,0]=4 486 B20R3.93114 Brc1ccc2cc(ccc2c1)OCC3=CCCC3 86ef76d66124158b6803bbf16a918479 [0,1,0,0,0,1|2,0,0]=4 487 B20R3.93114 Brc1ccc2cc(ccc2c1)OCc3ncc[nH]3 3fb6e190883a6437a70c144c1d555275 [0,1,0,0,0,1|0,0,2]=4 488 B20R3.93114 Brc1ccc2cc(ccc2c1)OCc3nnn[nH]3 e013c40731d5970b821da0c3ff219574 [0,1,0,0,0,1|2,0,0]=4 489 B20R3.93114 Cc1ccc2cc(ccc2c1)NCc3ncc[nH]3 ddca20e0415d80873ed8cfe7d669562f [0,1,0,0,0,1|0,0,2]=4 490 B20R3.93114 Cc1ccc2cc(ccc2c1)OCC3=CCCC3 f5760e37d16ccbe37bc2e164a10f2690 [0,1,0,0,0,1|2,0,0]=4 491 B20R3.93114 Cc1ccc2cc(ccc2c1)OCc3ncc[nH]3 c2f54f118b86708838bb8e8efb4fd204 [0,1,0,0,0,1|0,0,2]=4 492 B20R3.93114 Cc1ccc2cc(ccc2c1)OCc3nnn[nH]3 6ed893d1c7a6af380963d875a3968370 [0,1,0,0,0,1|2,0,0]=4 493 B20R3.93114 Clc1ccc2cc(ccc2c1)OCC3=CCCC3 4301de702374dda775bb9e1be4f567de [0,1,0,0,0,1|2,0,0]=4 494 B20R3.93114 Clc1ccc2cc(ccc2c1)OCc3ncc[nH]3 3704d0d6c4cec9bb7c09d379935238e4 [0,1,0,0,0,1|0,0,2]=4 495 B20R3.93114 Clc1ccc2cc(ccc2c1)OCc3nnn[nH]3 28279536eb2f0bf23c7f549e95634ff7 [0,1,0,0,0,1|2,0,0]=4 496 B20R3.93114 Fc1ccc2cc(ccc2c1)NCC3=CCCC3 fec0e5affc21e482149298929c6a8f65 [0,1,0,0,0,1|2,0,0]=4 497 B20R3.93114 Fc1ccc2cc(ccc2c1)NCc3ncc[nH]3 1dd402a14f43c661a38f0b6375bcb5d8 [0,1,0,0,0,1|0,0,2]=4 498 B20R3.93114 Fc1ccc2cc(ccc2c1)NCc3nnn[nH]3 126b4b76fc1a3ea528235f2eba500dbc [0,1,0,0,0,1|2,0,0]=4 499 B20R3.93114 Fc1ccc2cc(ccc2c1)OCC3=CCCC3 ad440aba8d6d8cc2283573ccd008426a [0,1,0,0,0,1|2,0,0]=4 500 B20R3.93114 Fc1ccc2cc(ccc2c1)OCc3ncc[nH]3 d5ac7f0762a4d4267f9d6fd5f47eda74 [0,1,0,0,0,1|0,0,2]=4 501 B20R3.93114 Fc1ccc2cc(ccc2c1)OCc3nnn[nH]3 060d40c5f6b476e7957573097776a8e7 [0,1,0,0,0,1|2,0,0]=4 502 B20R3.93114 Ic1ccc2cc(ccc2c1)OCC3=CCCC3 4acc2de6c566d3ea6d2aa0d5522b53b3 [0,1,0,0,0,1|2,0,0]=4 503 B20R3.93114 Ic1ccc2cc(ccc2c1)OCc3ncc[nH]3 586b319afec044044f5efb15a912d61d [0,1,0,0,0,1|0,0,2]=4 504 B20R3.93114 Ic1ccc2cc(ccc2c1)OCc3nnn[nH]3 74ecf1f79ca27bdd40db8796527e0f48 [0,1,0,0,0,1|2,0,0]=4 505 B20R3.93114 Oc1ccc2cc(ccc2c1)CNc3ncc[nH]3 0792d17364bdacbb416f3e6d95ec526a [0,1,0,0,0,1|0,0,2]=4 506 B20R3.93114 Oc1ccc2cc(ccc2c1)NCc3ncc[nH]3 78e7b3aa5c2e1c102a2a04f8306b7643 [0,1,0,0,0,1|0,0,2]=4 507 B20R3.129490 Cn1ccnc1CNc2ccc3ccccc3c2 b032bd5ecb0a4e3da8813ea11d2ae979 [0,1,0,0,0,1|0,0,2]=4 508 B20R3.129490 Cn1ccnc1COc2ccc3ccccc3c2 72526fe443636c45053780e825bc52eb [0,1,0,0,0,1|0,0,2]=4 509 B20R3.129490 Cn1ccnc1NCc2ccc3ccccc3c2 83f66326d7d65245e747683f5e48b84e [0,1,0,0,0,1|0,0,2]=4 510 B20R3.129490 Cn1cnnc1NCc2ccc3ccccc3c2 2746be8a384b91f64728515d47a0b44b [0,1,0,0,0,1|1,0,1]=4 511 B20R3.129490 Cn1ncnc1NCc2ccc3ccccc3c2 186472145b2985fa2e5d200561c4001c [0,1,0,0,0,1|1,0,1]=4 512 B20R3.129490 Cn1nnnc1NCc2ccc3ccccc3c2 2bb6581bd0a1249823e1f9ad55b72bdb [0,1,0,0,0,1|2,0,0]=4 513 B20R3.129490 O=C1CCC=C1OCc2ccc3ccccc3c2 73e7e42d7954ec2062f7cba94dedb673 [0,1,0,0,0,1|2,0,0]=4 514 B20R3.250890 Brc1cccc2c1ccc(c2)NCC3=CCCC3 e722a47628b87290f1f587aa719e4478 [0,1,0,0,0,1|2,0,0]=4 515 B20R3.250890 Brc1cccc2c1ccc(c2)NCc3ncc[nH]3 cd91a85cb44a5ab5097ccd5e4056ef99 [0,1,0,0,0,1|0,0,2]=4 516 B20R3.250890 Brc1cccc2c1ccc(c2)OCC3=CCCC3 18ca9726c0223a4a75345d4e161731fb [0,1,0,0,0,1|2,0,0]=4 517 B20R3.250890 Brc1cccc2c1ccc(c2)OCc3ncc[nH]3 e8ec1be5605f002b003f54343151564a [0,1,0,0,0,1|0,0,2]=4 518 B20R3.250890 Brc1cccc2c1ccc(c2)OCc3nnn[nH]3 297ea23c985d1319cafd55338b93182d [0,1,0,0,0,1|2,0,0]=4 519 B20R3.250890 Clc1cccc2c1ccc(c2)OCC3=CCCC3 ae45a92aac2c8ee56bbb3e45531de614 [0,1,0,0,0,1|2,0,0]=4 520 B20R3.250890 Clc1cccc2c1ccc(c2)OCc3ncc[nH]3 04081a4526d30e35b9342c3745bc7df6 [0,1,0,0,0,1|0,0,2]=4 521 B20R3.250890 Clc1cccc2c1ccc(c2)OCc3nnn[nH]3 362b647391cda178362e6aa584a89f5f [0,1,0,0,0,1|2,0,0]=4 522 B20R3.250890 Fc1cccc2c1ccc(c2)OCC3=CCCC3 6daf5b17dacac8a73d1f2cfe765bf363 [0,1,0,0,0,1|2,0,0]=4 523 B20R3.250890 Fc1cccc2c1ccc(c2)OCc3ncc[nH]3 87303967488fd50305a4d1454c184a99 [0,1,0,0,0,1|0,0,2]=4 524 B20R3.250890 Fc1cccc2c1ccc(c2)OCc3nnn[nH]3 e90a8757cf5e211e9d202000ed0718ca [0,1,0,0,0,1|2,0,0]=4 525 B20R3.250890 Oc1cccc2c1ccc(c2)NCc3ncc[nH]3 14628b04e8d3da80c8f6b77a0f51b70c [0,1,0,0,0,1|0,0,2]=4 526 B20R3.281927 Brc1cc(cc2c1cccc2)CNc3ncc[nH]3 b0697cc08ccb36a3655c12eb22329d15 [0,1,0,0,0,1|0,0,2]=4 527 B20R3.281927 Brc1cc(cc2c1cccc2)NCC3=CCCC3 e60d7d1b7bb8f8cf5b789e30d08b1f5c [0,1,0,0,0,1|2,0,0]=4 528 B20R3.281927 Brc1cc(cc2c1cccc2)NCc3ncc[nH]3 f90d3ea7fa0a48904d92201c65e8df4b [0,1,0,0,0,1|0,0,2]=4 529 B20R3.281927 Brc1cc(cc2c1cccc2)NCc3nnn[nH]3 73510dd552d036171333ac5b44d29844 [0,1,0,0,0,1|2,0,0]=4 530 B20R3.281927 Brc1cc(cc2c1cccc2)OCC3=CCCC3 75afa1f952d7c3491eaed4f5e50fa9d8 [0,1,0,0,0,1|2,0,0]=4 531 B20R3.281927 Brc1cc(cc2c1cccc2)OCc3ncc[nH]3 85308dad77f3b395cb6209460498a4e0 [0,1,0,0,0,1|0,0,2]=4 532 B20R3.281927 Brc1cc(cc2c1cccc2)OCc3nnn[nH]3 bd06175c36b5a89ff1cfc2ac278bb5dd [0,1,0,0,0,1|2,0,0]=4 533 B20R3.281927 Cc1cc(cc2c1cccc2)OCc3ncc[nH]3 5871abd55abd357acc0c1e538ec1294b [0,1,0,0,0,1|0,0,2]=4 534 B20R3.281927 Cc1cc(cc2c1cccc2)OCc3nnn[nH]3 27e22177c53e365b5241742ebb362af3 [0,1,0,0,0,1|2,0,0]=4 535 B20R3.281927 Clc1cc(cc2c1cccc2)CNc3ncc[nH]3 4cff7a31a1b92b584147a4b04aa48900 [0,1,0,0,0,1|0,0,2]=4 536 B20R3.281927 Oc1cc(cc2c1cccc2)NCc3ncc[nH]3 9ccd8db3e902734b337933beb9171b6c [0,1,0,0,0,1|0,0,2]=4 537 B20R3.331512 CC(Nc1ncc[nH]1)c2ccc3ccccc3c2 92aed1fdd62cac344a5764650f536ef6 [0,1,0,0,0,1|0,0,2]=4 538 B20R3.331512 CN(Cc1ncc[nH]1)c2ccc3ccccc3c2 7984d235d1677c80978a64c3b4844947 [0,1,0,0,0,1|0,0,2]=4 539 B20R3.331512 CN(Cc1nnn[nH]1)c2ccc3ccccc3c2 377a92a227c5088616fc60a9b491f1c6 [0,1,0,0,0,1|2,0,0]=4 540 B20R3.331512 C[C@@H](Nc1ncc[nH]1)c2ccc3ccccc3c2 322803bd9786bfaeeb5fca37e5dc880c [0,1,0,0,0,1|0,0,2]=4 541 B20R3.331512 C[C@H](Nc1ncc[nH]1)c2ccc3ccccc3c2 39d9331841d74bade2635d32b1bf30f4 [0,1,0,0,0,1|0,0,2]=4 542 B20R3.2857533 Brc1c(ccc2c1cccc2)CNc3ncc[nH]3 5ffb39836d20acede709c12fa0b35abf [0,1,0,0,0,1|0,0,2]=4 543 B20R3.2857533 Brc1c(ccc2c1cccc2)NCC3=CCCC3 a5b38fea2a8b70210eef895bcd453f75 [0,1,0,0,0,1|2,0,0]=4 544 B20R3.2857533 Brc1c(ccc2c1cccc2)NCc3ncc[nH]3 ffdc9db87f7f04e2158acb4ad1a6e529 [0,1,0,0,0,1|0,0,2]=4 545 B20R3.2857533 Brc1c(ccc2c1cccc2)NCc3nnn[nH]3 e35264de4c2289b5484fb7d6f47952a0 [0,1,0,0,0,1|2,0,0]=4 546 B20R3.2857533 Brc1c(ccc2c1cccc2)OCc3ncc[nH]3 7e2e7a03d0f984a8901a619680910faf [0,1,0,0,0,1|0,0,2]=4 547 B20R3.2857533 Cc1c(ccc2c1cccc2)NCc3ncc[nH]3 2810ae2c9a7d5a18804cb66ce66105c0 [0,1,0,0,0,1|0,0,2]=4 548 B20R3.2857533 Cc1c(ccc2c1cccc2)NCc3ncn[nH]3 a7e48f49b032198b46e9a1b6bb064d2f [0,1,0,0,0,1|1,0,1]=4 549 B20R3.2857533 Cc1c(ccc2c1cccc2)OCc3ncc[nH]3 b5d7efb54134cb5df3c12375a3ad5333 [0,1,0,0,0,1|0,0,2]=4 550 B20R3.2857533 Cc1c(ccc2c1cccc2)OCc3nnn[nH]3 7468c06cee7012622149df5ebce4edf0 [0,1,0,0,0,1|2,0,0]=4 551 B20R3.2857533 Clc1c(ccc2c1cccc2)NCC3=CCCC3 bd124eeafc269d94c513b0cf5c8a584f [0,1,0,0,0,1|2,0,0]=4 552 B20R3.2857533 Clc1c(ccc2c1cccc2)NCc3ncc[nH]3 4ec8c506a4d3364299d2bf05be95cb92 [0,1,0,0,0,1|0,0,2]=4 553 B20R3.2857533 Clc1c(ccc2c1cccc2)NCc3nnn[nH]3 b3bbc94213c6bf582d7d7a125ea827d0 [0,1,0,0,0,1|2,0,0]=4 554 B20R3.2857533 Clc1c(ccc2c1cccc2)OCC3=CCCC3 439e517f74b9d4d804315227e4abc716 [0,1,0,0,0,1|2,0,0]=4 555 B20R3.2857533 Clc1c(ccc2c1cccc2)OCc3ncc[nH]3 d66b7c1d0f09c2625a429b3e42b76066 [0,1,0,0,0,1|0,0,2]=4 556 B20R3.2857533 Clc1c(ccc2c1cccc2)OCc3nnn[nH]3 24aa4fd27c8fc1ddc8791af603d88e1c [0,1,0,0,0,1|2,0,0]=4 557 B20R3.2857533 Fc1c(ccc2c1cccc2)NCC3=CCCC3 ed9db2d62b1eea36e45360645f632fb1 [0,1,0,0,0,1|2,0,0]=4 558 B20R3.2857533 Fc1c(ccc2c1cccc2)NCc3ncc[nH]3 e7463534a216ebd0a799212e8a2f8556 [0,1,0,0,0,1|0,0,2]=4 559 B20R3.2857533 Fc1c(ccc2c1cccc2)NCc3ncn[nH]3 bfd43f98356b08012ff495b68a06b6e7 [0,1,0,0,0,1|1,0,1]=4 560 B20R3.2857533 Fc1c(ccc2c1cccc2)NCc3nnn[nH]3 87fe5a5d7e01f2f736cd05cca3a66922 [0,1,0,0,0,1|2,0,0]=4 561 B20R3.2857533 Fc1c(ccc2c1cccc2)OCc3ncc[nH]3 b36cc583da1bd76b127d5239a8527539 [0,1,0,0,0,1|0,0,2]=4 562 B20R3.2857533 Fc1c(ccc2c1cccc2)OCc3nnn[nH]3 dc6e4d06d9ddc1f20cdbe6449483a4d0 [0,1,0,0,0,1|2,0,0]=4 563 B20R3.2857533 Ic1c(ccc2c1cccc2)NCC3=CCCC3 6cdee95a8e586e3eb6dc75677b905f77 [0,1,0,0,0,1|2,0,0]=4 564 B20R3.2857533 Ic1c(ccc2c1cccc2)NCc3ncc[nH]3 c474b95aff9b67ee147017caa39b66ad [0,1,0,0,0,1|0,0,2]=4 565 B20R3.2857533 Ic1c(ccc2c1cccc2)NCc3nnn[nH]3 b5f80a564144f7fd07ea42abc1e4c732 [0,1,0,0,0,1|2,0,0]=4 566 B20R3.2857533 Ic1c(ccc2c1cccc2)OCC3=CCCC3 bd908a736204600e55e245ec7573c545 [0,1,0,0,0,1|2,0,0]=4 567 B20R3.2857533 Ic1c(ccc2c1cccc2)OCc3ncc[nH]3 836f13dd311b00b1083ded31da14584f [0,1,0,0,0,1|0,0,2]=4 568 B20R3.2857533 Ic1c(ccc2c1cccc2)OCc3nnn[nH]3 45924c51b415f763623706c24f6d39dc [0,1,0,0,0,1|2,0,0]=4 569 B20R3.2857533 Oc1c(ccc2c1cccc2)NCc3ncn[nH]3 687a3e4a0a27760a0ae72901a7fea0a7 [0,1,0,0,0,1|1,0,1]=4 570 B20R3.4390679 Brc1cccc2c1cc(cc2)NCC3=CCCC3 5d3db8020b887b9d9d824f146dbfbdec [0,1,0,0,0,1|2,0,0]=4 571 B20R3.4390679 Brc1cccc2c1cc(cc2)NCc3ncc[nH]3 0eaedf05cfff623e25cfb1b011060b70 [0,1,0,0,0,1|0,0,2]=4 572 B20R3.4390679 Brc1cccc2c1cc(cc2)NCc3nnn[nH]3 ac93dd6286ff15f8e539076a04160386 [0,1,0,0,0,1|2,0,0]=4 573 B20R3.4390679 Brc1cccc2c1cc(cc2)OCc3ncc[nH]3 6eab7e763ecfe82971cfe1b6d8106a68 [0,1,0,0,0,1|0,0,2]=4 574 B20R3.4390679 Brc1cccc2c1cc(cc2)OCc3nnn[nH]3 d49df4ca6bc4cb63fe4f6d105d332611 [0,1,0,0,0,1|2,0,0]=4 575 B20R3.4390679 Cc1cccc2c1cc(cc2)OCC3=CCCC3 ff04388dda35662f92b6856c7f4dd1a4 [0,1,0,0,0,1|2,0,0]=4 576 B20R3.4390679 Cc1cccc2c1cc(cc2)OCc3ncc[nH]3 12aec339d47c2ca617ba78a5a57cbb6e [0,1,0,0,0,1|0,0,2]=4 577 B20R3.4390679 Cc1cccc2c1cc(cc2)OCc3nnn[nH]3 9cba75b9c2730a403b2657473f200f6f [0,1,0,0,0,1|2,0,0]=4 578 B20R3.4390679 Clc1cccc2c1cc(cc2)OCc3ncc[nH]3 8338c0f5a1e893ad75389317c0e2139b [0,1,0,0,0,1|0,0,2]=4 579 B20R3.4390679 Clc1cccc2c1cc(cc2)OCc3nnn[nH]3 dba3d8c75543c6c88a40581485a51441 [0,1,0,0,0,1|2,0,0]=4 580 B20R3.4390679 Fc1cccc2c1cc(cc2)OCC3=CCCC3 40a68b681452575452038a1c4d42b67d [0,1,0,0,0,1|2,0,0]=4 581 B20R3.4390679 Fc1cccc2c1cc(cc2)OCc3ncc[nH]3 f2e0b4295021a97476e9bef9b36a79f4 [0,1,0,0,0,1|0,0,2]=4 582 B20R3.4390679 Fc1cccc2c1cc(cc2)OCc3nnn[nH]3 93d5175d6a580e6f2bd5dd86ffd9f1a2 [0,1,0,0,0,1|2,0,0]=4 583 B20R3.4390679 Ic1cccc2c1cc(cc2)OCC3=CCCC3 993248550b63f6bdac525112d33077d4 [0,1,0,0,0,1|2,0,0]=4 584 B20R3.4390679 Ic1cccc2c1cc(cc2)OCc3ncc[nH]3 f063cff00620ab2bc2f85ffd93dc915a [0,1,0,0,0,1|0,0,2]=4 585 B20R3.4390679 Ic1cccc2c1cc(cc2)OCc3nnn[nH]3 6e2315cd1c5c7f074e440f92448e0944 [0,1,0,0,0,1|2,0,0]=4 586 B20R3.4390679 Oc1cccc2c1cc(cc2)NCc3ncc[nH]3 e951b126e4354b8d4d382dae5b68a1f2 [0,1,0,0,0,1|0,0,2]=4 587 B18R3.14214 CCNc1nc2c(s1)ccc3c2cccc3 af079f78f4b1e9ae4ecccbb27646dddc [0,0,1,1,0,0|1,0,0]=3 588 B18R3.14214 CCNc1nc2ccc3ccccc3c2s1 d433bb023085c5cbe67d20f1cb9ceca4 [0,0,1,1,0,0|2,0,0]=4 589 B18R3.14214 FCNc1nc2c(s1)ccc3c2cccc3 257a438de17eb2734868d389fc3c9d9e [0,0,1,1,0,0|2,0,0]=4 590 B18R3.14214 OCNc1nc2c(s1)ccc3c2cccc3 e0458c3d5edeb50d1a5c79ae7280c7fd [0,0,1,1,0,0|2,0,0]=4 591 B18R3.17797 C=Cc1ccccc1c2cnc3n2CCC3 8784b572d2bb42d2b29c744e02bae30e [0,0,1,1,0,0|2,0,0]=4 592 B18R3.228675 c1ccc2cc(ccc2c1)CCNC3CC3 77a5d4c9175c1270ecdbae4bd70a3de6 [0,0,1,1,0,0|1,0,1]=4 593 B18R3.228676 c1ccc2cc(ccc2c1)CCN3CCC3 48a7f4ec4cc0f9c1c5141a8defb0bff9 [0,0,1,1,0,0|1,0,1]=4 594 B16R2.767 CCNC(C)c1ccc2ccccc2c1 05786d3f56ae4eca702056c7a6eed762 [0,0,1,0,1,0|1,0,1]=4 595 B16R2.767 CCN[C@@H](C)c1ccc2ccccc2c1 2e81f848eb0e745b3914a0352c1b6c09 [0,0,1,0,1,0|1,0,1]=4 596 B16R2.767 CCN[C@H](C)c1ccc2ccccc2c1 4891972990f0dafa224a0761810c5941 [0,0,1,0,1,0|1,0,1]=4 597 B16R3.63903 c1ccc2cc(ccc2c1)NC3CC3 61594b5cd1a25d1cc17370c2cb30a614 [0,0,0,0,2,0|1,0,1]=4 598 B16R3.63903 c1ccc2cc(ccc2c1)OC3CC3 67b1654f13796f300b1b2c02a245561a [0,0,0,0,2,0|1,0,1]=4 599 B20R3.30190 C1=C(CCCC1)CNc2ccc3ccccc3c2 73f66cef762ca51110c68448522b2029 [0,0,0,0,0,2|2,0,0]=4 600 B20R3.30190 C1=C(CCCC1)COc2ccc3ccccc3c2 9d67726a540e836d6343cbf34ed8074e [0,0,0,0,0,2|2,0,0]=4 601 B20R3.30190 C1=C(CCOC1)CNc2ccc3ccccc3c2 9290c02a36a39036281998b0274959d2 [0,0,0,0,0,2|2,0,0]=4 602 B20R3.30190 C1=C(CCOC1)COc2ccc3ccccc3c2 e5d0e5022787ee9f1aba38fbb1f7203d [0,0,0,0,0,2|2,0,0]=4 603 B20R3.105088 C1=C(CCC1)CNCc2ccc3ccccc3c2 abe05da16dfb6063d808dfd34370c036 [0,0,0,0,0,2|2,0,0]=4 604 B20R3.105088 C1=C(CCC1)COCc2ccc3ccccc3c2 ea529c87f929bd5b2ec4804ffc1fa35a [0,0,0,0,0,2|2,0,0]=4 605 B20R3.105088 c1ccc2cc(ccc2c1)CCNc3ncc[nH]3 a5eb77bd1551ef38d21983969ce405c7 [0,0,0,0,0,2|0,0,2]=4 606 B20R3.105088 c1ccc2cc(ccc2c1)CNCc3ncc[nH]3 dc70341e89a40bdc434b8b21f6bf9f2a [0,0,0,0,0,2|0,0,2]=4 607 B20R3.105088 c1ccc2cc(ccc2c1)CNCc3ncn[nH]3 c936b1b3a73f0ac4c0e01028501ebd73 [0,0,0,0,0,2|1,0,1]=4 608 B20R3.105088 c1ccc2cc(ccc2c1)CNCc3nnn[nH]3 7ba9e1fadcc0ae3aaada6141084b610a [0,0,0,0,0,2|2,0,0]=4 609 B20R3.105088 c1ccc2cc(ccc2c1)COCc3ncc[nH]3 5ff2336c593e6e6ed10bb20ffc64558a [0,0,0,0,0,2|0,0,2]=4 610 B20R3.105088 c1ccc2cc(ccc2c1)NCCc3ncc[nH]3 96dd85537de69f68b35b02c8cf33de08 [0,0,0,0,0,2|0,0,2]=4 611 B20R3.105088 c1ccc2cc(ccc2c1)NCCc3nnn[nH]3 32d91b9c7774bdf00eb0cbe289fe2fad [0,0,0,0,0,2|2,0,0]=4 612 B20R3.105088 c1ccc2cc(ccc2c1)OCCc3nnn[nH]3 f54aa10ade532abcc1462a808ea95c2a [0,0,0,0,0,2|2,0,0]=4